N-[3-methyl-4-(5H-pyrido[2,3-b][1,5]benzoxazepin-6-ylcarbonyl)phenyl]-2-thiophen-3-yl-benzamide

Systemtic Name: N-[3-methyl-4-(5H-pyrido[2,3-b][1,5]benzoxazepin-6-ylcarbonyl)phenyl]-2-thiophen-3-yl-benzamide Openeye Name: N-[3-methyl-4-(5H-pyrido[2,3-b][1,5]benzoxazepine-6-carbonyl)phenyl]-2-(3-thienyl)benzamide CAS Name: N-[3-methyl-4-[oxo(5H-pyrido[2,3-b][1,5]benzoxazepin-6-yl)methyl]phenyl]-2-(3-thiophenyl)benzamide IUPAC Name: N-[3-methyl-4-(5H-pyrido[2,3-b][1,5]benzoxazepine-6-carbonyl)phenyl]-2-thiophen-3-ylbenzamide Traditional Name: N-[3-methyl-4-(5H-pyrido[2,3-b][1,5]benzoxazepine-6-carbonyl)phenyl]-2-(3-thienyl)benzamide Formula: C31H23N3O3S MolecularWeight: 517.59762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC=CC=C2C3=CSC=C3)C(=O)N4CC5=C(N=CC=C5)OC6=CC=CC=C64

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC=CC=C2C3=CSC=C3)C(=O)N4CC5=C(N=CC=C5)OC6=CC=CC=C64

InChI

InChI=1S/C31H23N3O3S/c1-20-17-23(33-29(35)26-9-3-2-8-25(26)22-14-16-38-19-22)12-13-24(20)31(36)34-18-21-7-6-15-32-30(21)37-28-11-5-4-10-27(28)34/h2-17,19H,18H2,1H3,(H,33,35)