4-[(3-chlorophenyl)methyl]-1-(3-methylthiophen-2-yl)carbonyl-1,4-diazepan-5-one

Systemtic Name: 4-[(3-chlorophenyl)methyl]-1-(3-methylthiophen-2-yl)carbonyl-1,4-diazepan-5-one Openeye Name: 4-[(3-chlorophenyl)methyl]-1-(3-methylthiophene-2-carbonyl)-1,4-diazepan-5-one CAS Name: 4-[(3-chlorophenyl)methyl]-1-[(3-methyl-2-thiophenyl)-oxomethyl]-1,4-diazepan-5-one IUPAC Name: 4-[(3-chlorophenyl)methyl]-1-(3-methylthiophene-2-carbonyl)-1,4-diazepan-5-one Traditional Name: 4-(3-chlorobenzyl)-1-(3-methylthiophene-2-carbonyl)-1,4-diazepan-5-one Formula: C18H19ClN2O2S MolecularWeight: 362.87366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)N2CCC(=O)N(CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(SC=C1)C(=O)N2CCC(=O)N(CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H19ClN2O2S/c1-13-6-10-24-17(13)18(23)20-7-5-16(22)21(9-8-20)12-14-3-2-4-15(19)11-14/h2-4,6,10-11H,5,7-9,12H2,1H3