9,9-dimethyl-6-phenyl-5-thiophen-2-ylcarbonyl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 9,9-dimethyl-6-phenyl-5-thiophen-2-ylcarbonyl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one Openeye Name: 9,9-dimethyl-6-phenyl-5-(thiophene-2-carbonyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one CAS Name: 9,9-dimethyl-5-[oxo(thiophen-2-yl)methyl]-6-phenyl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one IUPAC Name: 9,9-dimethyl-6-phenyl-5-(thiophene-2-carbonyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one Traditional Name: 9,9-dimethyl-6-phenyl-5-(2-thenoyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one Formula: C26H24N2O2S MolecularWeight: 428.54596

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C4=CC=CS4)C5=CC=CC=C5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C4=CC=CS4)C5=CC=CC=C5)C(=O)C1)C

InChI

InChI=1S/C26H24N2O2S/c1-26(2)15-19-23(21(29)16-26)24(17-9-4-3-5-10-17)28(25(30)22-13-8-14-31-22)20-12-7-6-11-18(20)27-19/h3-14,24,27H,15-16H2,1-2H3