4,9-diamino-8-(4-bromobenzoyl)-2-(2-methylphenyl)-7-thia-5-azabicyclo[4.3.0]nona-2,4,8,10-tetraene-3-carbonitrile
Molecular Formula:
C
22
H
15
BrN
4
OS
InChI:
InChI=1/C22H15BrN4OS/c1-11-4-2-3-5-14(11)16-15(10-24)21(26)27-22-17(16)18(25)20(29-22)19(28)12-6-8-13(23)9-7-12/h2-9H,25H2,1H3,(H2,26,27)/f/h26H2
InChIKey:
InChIKey=IKEFCRVARDHWHC-CKFYMFOVCX
SMILES:
CC1=CC=CC=C1C2=C(C(=NC3=C2C(=C(S3)C(=O)C4=CC=C(C=C4)Br)N)N)C#N
Names:
4,9-diamino-8-(4-bromobenzoyl)-2-(2-methylphenyl)-7-thia-5-azabicyclo[4.3.0]nona-2,4,8,10-tetraene-3-carbonitrile
Registries:
PubChem CID 1068793
PubChem ID 3304614