methyl 2-[[7-(2-methoxyphenyl)-9-phenyl-3,5,7-triazabicyclo[4.3.0]nona-2,4,8,10-tetraen-2-yl]sulfanyl]butanoate
Molecular Formula:
C24H23N3O3S
InChI: InChI=1/C24H23N3O3S/c1-4-20(24(28)30-3)31-23-21-17(16-10-6-5-7-11-16)14-27(22(21)25-15-26-23)18-12-8-9-13-19(18)29-2/h5-15,20H,4H2,1-3H3
InChIKey: InChIKey=CCPGULAPWHKWQR-UHFFFAOYAC
SMILES: CCC(C(=O)OC)SC1=NC=NC2=C1C(=CN2C3=CC=CC=C3OC)C4=CC=CC=C4 Names:
methyl 2-[[7-(2-methoxyphenyl)-9-phenyl-3,5,7-triazabicyclo[4.3.0]nona-2,4,8,10-tetraen-2-yl]sulfanyl]butanoate Registries:
ChemSpider: InChIKey=CCPGULAPWHKWQR-UHFFFAOYAC
PubChem CID 4114274
PubChem ID 6041175
InChI: InChI=1/C24H23N3O3S/c1-4-20(24(28)30-3)31-23-21-17(16-10-6-5-7-11-16)14-27(22(21)25-15-26-23)18-12-8-9-13-19(18)29-2/h5-15,20H,4H2,1-3H3
InChIKey: InChIKey=CCPGULAPWHKWQR-UHFFFAOYAC
SMILES: CCC(C(=O)OC)SC1=NC=NC2=C1C(=CN2C3=CC=CC=C3OC)C4=CC=CC=C4 Names:
methyl 2-[[7-(2-methoxyphenyl)-9-phenyl-3,5,7-triazabicyclo[4.3.0]nona-2,4,8,10-tetraen-2-yl]sulfanyl]butanoate Registries:
ChemSpider: InChIKey=CCPGULAPWHKWQR-UHFFFAOYAC
PubChem CID 4114274
PubChem ID 6041175
