2-(4-methylthiophen-2-yl)-N-[4-(2,4,6,8-tetrahydro-1H-[1,4]oxazino[4,3-a][1,4]benzodiazepin-11-ylcarbonyl)phenyl]benzamide

Systemtic Name: 2-(4-methylthiophen-2-yl)-N-[4-(2,4,6,8-tetrahydro-1H-[1,4]oxazino[4,3-a][1,4]benzodiazepin-11-ylcarbonyl)phenyl]benzamide Openeye Name: 2-(4-methyl-2-thienyl)-N-[4-(2,4,6,8-tetrahydro-1H-[1,4]oxazino[4,3-a][1,4]benzodiazepine-11-carbonyl)phenyl]benzamide CAS Name: 2-(4-methyl-2-thiophenyl)-N-[4-[oxo(2,4,6,8-tetrahydro-1H-[1,4]oxazino[4,3-a][1,4]benzodiazepin-11-yl)methyl]phenyl]benzamide IUPAC Name: 2-(4-methylthiophen-2-yl)-N-[4-(2,4,6,8-tetrahydro-1H-[1,4]oxazino[4,3-a][1,4]benzodiazepine-11-carbonyl)phenyl]benzamide Traditional Name: 2-(4-methyl-2-thienyl)-N-[4-(2,4,6,8-tetrahydro-1H-[1,4]oxazino[4,3-a][1,4]benzodiazepine-11-carbonyl)phenyl]benzamide Formula: C31H27N3O3S MolecularWeight: 521.62938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=O)C4=C5C(=CNC=C6N5CCOC6)CC=C4

Isomeric SMILES

CC1=CSC(=C1)C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=O)C4=C5C(=CNC=C6N5CCOC6)CC=C4

InChI

InChI=1S/C31H27N3O3S/c1-20-15-28(38-19-20)25-6-2-3-7-26(25)31(36)33-23-11-9-21(10-12-23)30(35)27-8-4-5-22-16-32-17-24-18-37-14-13-34(24)29(22)27/h2-4,6-12,15-17,19,32H,5,13-14,18H2,1H3,(H,33,36)