4-(4-butylcyclohexyl)carbonyl-7-methyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 4-(4-butylcyclohexyl)carbonyl-7-methyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 4-(4-butylcyclohexanecarbonyl)-7-methyl-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 4-[(4-butylcyclohexyl)-oxomethyl]-7-methyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 4-(4-butylcyclohexanecarbonyl)-7-methyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 4-(4-butylcyclohexanecarbonyl)-7-methyl-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C25H32N2O2S MolecularWeight: 424.59878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CS4)C=C(C=C3)C

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CS4)C=C(C=C3)C

InChI

InChI=1S/C25H32N2O2S/c1-3-4-6-18-9-11-19(12-10-18)25(29)27-16-23(28)26-21-13-8-17(2)15-20(21)24(27)22-7-5-14-30-22/h5,7-8,13-15,18-19,24H,3-4,6,9-12,16H2,1-2H3,(H,26,28)