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

Systemtic Name: 7-bromanyl-4-(3-cyclopentylpropanoyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-4-(3-cyclopentylpropanoyl)-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-4-(3-cyclopentyl-1-oxopropyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-4-(3-cyclopentylpropanoyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-4-(3-cyclopentylpropanoyl)-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C21H23BrN2O2S MolecularWeight: 447.38852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)N2CC(=O)NC3=C(C2C4=CC=CS4)C=C(C=C3)Br

Isomeric SMILES

C1CCC(C1)CCC(=O)N2CC(=O)NC3=C(C2C4=CC=CS4)C=C(C=C3)Br

InChI

InChI=1S/C21H23BrN2O2S/c22-15-8-9-17-16(12-15)21(18-6-3-11-27-18)24(13-19(25)23-17)20(26)10-7-14-4-1-2-5-14/h3,6,8-9,11-12,14,21H,1-2,4-5,7,10,13H2,(H,23,25)