3-methanethioyl-N-[4-(propan-2-ylamino)cyclohepta[b]indol-7-yl]benzamide

Systemtic Name: 3-methanethioyl-N-[4-(propan-2-ylamino)cyclohepta[b]indol-7-yl]benzamide Openeye Name: N-[4-(isopropylamino)cyclohepta[b]indol-7-yl]-3-methanethioyl-benzamide CAS Name: 3-methanethioyl-N-[4-(propan-2-ylamino)-7-cyclohepta[b]indolyl]benzamide IUPAC Name: 3-methanethioyl-N-[4-(propan-2-ylamino)cyclohepta[b]indol-7-yl]benzamide Traditional Name: N-[4-(isopropylamino)cyclohept[b]indol-7-yl]-3-thioformyl-benzamide Formula: C24H21N3OS MolecularWeight: 399.50804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=CC=CC2=C3C=CC=C(C=C3N=C21)NC(=O)C4=CC=CC(=C4)C=S

Isomeric SMILES

CC(C)NC1=CC=CC2=C3C=CC=C(C=C3N=C21)NC(=O)C4=CC=CC(=C4)C=S

InChI

InChI=1S/C24H21N3OS/c1-15(2)25-21-11-5-10-20-19-9-4-8-18(13-22(19)27-23(20)21)26-24(28)17-7-3-6-16(12-17)14-29/h3-15,25H,1-2H3,(H,26,28)