N-(6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-2-(4-propan-2-ylsulfanylphenyl)ethanamide

Systemtic Name: N-(6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-2-(4-propan-2-ylsulfanylphenyl)ethanamide Openeye Name: 2-(4-isopropylsulfanylphenyl)-N-(6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)acetamide CAS Name: N-(6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-2-[4-(propan-2-ylthio)phenyl]acetamide IUPAC Name: N-(6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-2-(4-propan-2-ylsulfanylphenyl)acetamide Traditional Name: 2-[4-(isopropylthio)phenyl]-N-(6-keto-5H-benzo[b][1,4]benzoxazepin-8-yl)acetamide Formula: C24H22N2O3S MolecularWeight: 418.50808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)CC(=O)NC2=CC3=C(C=C2)OC4=CC=CC=C4NC3=O

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)CC(=O)NC2=CC3=C(C=C2)OC4=CC=CC=C4NC3=O

InChI

InChI=1S/C24H22N2O3S/c1-15(2)30-18-10-7-16(8-11-18)13-23(27)25-17-9-12-21-19(14-17)24(28)26-20-5-3-4-6-22(20)29-21/h3-12,14-15H,13H2,1-2H3,(H,25,27)(H,26,28)