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

Systemtic Name: 7-bromanyl-4-butanoyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-4-butanoyl-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-4-(1-oxobutyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-4-butanoyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-4-butyryl-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C17H17BrN2O2S MolecularWeight: 393.29808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17BrN2O2S/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)