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

Systemtic Name: 7-bromanyl-4-(2-phenylbutanoyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-4-(2-phenylbutanoyl)-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-4-(1-oxo-2-phenylbutyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-4-(2-phenylbutanoyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-4-(2-phenylbutanoyl)-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C23H21BrN2O2S MolecularWeight: 469.39404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CS4)C=C(C=C3)Br

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CS4)C=C(C=C3)Br

InChI

InChI=1S/C23H21BrN2O2S/c1-2-17(15-7-4-3-5-8-15)23(28)26-14-21(27)25-19-11-10-16(24)13-18(19)22(26)20-9-6-12-29-20/h3-13,17,22H,2,14H2,1H3,(H,25,27)