3-[(1-benzyl-2,5-dimethyl-pyrrol-3-yl)methylidene]-8-ethyl-2-imino-7-thia-1,5,9-triazabicyclo[4.3.0]nona-5,8-dien-4-one
Molecular Formula:
C
21
H
21
N
5
OS
InChI:
InChI=1/C21H21N5OS/c1-4-18-24-26-19(22)17(20(27)23-21(26)28-18)11-16-10-13(2)25(14(16)3)12-15-8-6-5-7-9-15/h5-11,22H,4,12H2,1-3H3/b17-11u,22-19+
InChIKey:
InChIKey=DZQFQCCIVDUHLZ-CRSPIDQSBL
SMILES:
CCC1=NN2C(=N)C(=CC3=C(N(C(=C3)C)CC4=CC=CC=C4)C)C(=O)N=C2S1
Names:
3-[(1-benzyl-2,5-dimethyl-pyrrol-3-yl)methylidene]-8-ethyl-2-imino-7-thia-1,5,9-triazabicyclo[4.3.0]nona-5,8-dien-4-one
Registries:
PubChem CID 3544305
PubChem ID 4789040
