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

Systemtic Name: 4-(2-ethylbutanoyl)-7-fluoranyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 4-(2-ethylbutanoyl)-7-fluoro-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 4-(2-ethyl-1-oxobutyl)-7-fluoro-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 4-(2-ethylbutanoyl)-7-fluoro-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 4-(2-ethylbutanoyl)-7-fluoro-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C19H21FN2O2S MolecularWeight: 360.445643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21FN2O2S/c1-3-12(4-2)19(24)22-11-17(23)21-15-8-7-13(20)10-14(15)18(22)16-6-5-9-25-16/h5-10,12,18H,3-4,11H2,1-2H3,(H,21,23)