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

Systemtic Name: 4-(4-butylcyclohexyl)carbonyl-7-fluoranyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 4-(4-butylcyclohexanecarbonyl)-7-fluoro-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 4-[(4-butylcyclohexyl)-oxomethyl]-7-fluoro-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 4-(4-butylcyclohexanecarbonyl)-7-fluoro-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 4-(4-butylcyclohexanecarbonyl)-7-fluoro-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C24H29FN2O2S MolecularWeight: 428.562663

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CS4)C=C(C=C3)F

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CS4)C=C(C=C3)F

InChI

InChI=1S/C24H29FN2O2S/c1-2-3-5-16-7-9-17(10-8-16)24(29)27-15-22(28)26-20-12-11-18(25)14-19(20)23(27)21-6-4-13-30-21/h4,6,11-14,16-17,23H,2-3,5,7-10,15H2,1H3,(H,26,28)