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

Systemtic Name: N-[2-methyl-4-(2-methylpropyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide Openeye Name: N-(4-isobutyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)thiophene-2-carboxamide CAS Name: N-[2-methyl-4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-thiophenecarboxamide IUPAC Name: N-[2-methyl-4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide Traditional Name: N-(4-isobutyl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)thiophene-2-carboxamide Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O3S/c1-12(2)10-21-11-14-9-15(20-18(22)17-5-4-8-25-17)6-7-16(14)24-13(3)19(21)23/h4-9,12-13H,10-11H2,1-3H3,(H,20,22)