3-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-9-(2,4-dimethylphenyl)-4-phenyl-8-sulfanylidene-7-thia-2,4,9-triazabicyclo[4.3.0]nona-2,10-dien-5-one
Molecular Formula:
C27H28N4O2S3
InChI: InChI=1/C27H28N4O2S3/c1-18-12-13-21(19(2)16-18)31-24-23(36-27(31)34)25(33)30(20-10-6-5-7-11-20)26(28-24)35-17-22(32)29-14-8-3-4-9-15-29/h5-7,10-13,16H,3-4,8-9,14-15,17H2,1-2H3
InChIKey: InChIKey=OQSOPAULDKMAQM-UHFFFAOYAA
SMILES: CC1=CC(=C(C=C1)N2C3=C(C(=O)N(C(=N3)SCC(=O)N4CCCCCC4)C5=CC=CC=C5)SC2=S)C
Names:
3-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-9-(2,4-dimethylphenyl)-4-phenyl-8-sulfanylidene-7-thia-2,4,9-triazabicyclo[4.3.0]nona-2,10-dien-5-one
Registries:
PubChem CID 3567398
PubChem ID 4830932
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