4-butanoyl-7-fluoranyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 4-butanoyl-7-fluoranyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 4-butanoyl-7-fluoro-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-fluoro-4-(1-oxobutyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 4-butanoyl-7-fluoro-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 4-butyryl-7-fluoro-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C17H17FN2O2S MolecularWeight: 332.392483

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CC(=O)NC2=C(C1C3=CC=CS3)C=C(C=C2)F

Isomeric SMILES

CCCC(=O)N1CC(=O)NC2=C(C1C3=CC=CS3)C=C(C=C2)F

InChI

InChI=1S/C17H17FN2O2S/c1-2-4-16(22)20-10-15(21)19-13-7-6-11(18)9-12(13)17(20)14-5-3-8-23-14/h3,5-9,17H,2,4,10H2,1H3,(H,19,21)