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

Systemtic Name: 7-chloranyl-4-(2-methylpropanoyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-4-(2-methylpropanoyl)-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-4-(2-methyl-1-oxopropyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-4-(2-methylpropanoyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-4-isobutyryl-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C17H17ClN2O2S MolecularWeight: 348.84708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CC(=O)NC2=C(C1C3=CC=CS3)C=C(C=C2)Cl

Isomeric SMILES

CC(C)C(=O)N1CC(=O)NC2=C(C1C3=CC=CS3)C=C(C=C2)Cl

InChI

InChI=1S/C17H17ClN2O2S/c1-10(2)17(22)20-9-15(21)19-13-6-5-11(18)8-12(13)16(20)14-4-3-7-23-14/h3-8,10,16H,9H2,1-2H3,(H,19,21)