4-(3,4-diethoxyphenyl)carbonyl-7-fluoranyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 4-(3,4-diethoxyphenyl)carbonyl-7-fluoranyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 4-(3,4-diethoxybenzoyl)-7-fluoro-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 4-[(3,4-diethoxyphenyl)-oxomethyl]-7-fluoro-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 4-(3,4-diethoxybenzoyl)-7-fluoro-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 4-(3,4-diethoxybenzoyl)-7-fluoro-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C24H23FN2O4S MolecularWeight: 454.513823

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CS4)C=C(C=C3)F)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CS4)C=C(C=C3)F)OCC

InChI

InChI=1S/C24H23FN2O4S/c1-3-30-19-10-7-15(12-20(19)31-4-2)24(29)27-14-22(28)26-18-9-8-16(25)13-17(18)23(27)21-6-5-11-32-21/h5-13,23H,3-4,14H2,1-2H3,(H,26,28)