N-[2-methyl-3-oxidanylidene-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide

Systemtic Name: N-[2-methyl-3-oxidanylidene-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide Openeye Name: N-(4-benzyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)thiophene-2-carboxamide CAS Name: N-[2-methyl-3-oxo-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]-2-thiophenecarboxamide IUPAC Name: N-(4-benzyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)thiophene-2-carboxamide Traditional Name: N-(4-benzyl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)thiophene-2-carboxamide Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C22H20N2O3S/c1-15-22(26)24(13-16-6-3-2-4-7-16)14-17-12-18(9-10-19(17)27-15)23-21(25)20-8-5-11-28-20/h2-12,15H,13-14H2,1H3,(H,23,25)