4-(2,5-dimethylthiophen-3-yl)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]-4-oxidanylidene-butanamide

Systemtic Name: 4-(2,5-dimethylthiophen-3-yl)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]-4-oxidanylidene-butanamide Openeye Name: 4-(2,5-dimethyl-3-thienyl)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]-4-oxo-butanamide CAS Name: 4-(2,5-dimethyl-3-thiophenyl)-N-[(1-methyl-2-imidazolyl)-phenylmethyl]-4-oxobutanamide IUPAC Name: 4-(2,5-dimethylthiophen-3-yl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-4-oxobutanamide Traditional Name: 4-(2,5-dimethyl-3-thienyl)-4-keto-N-[(1-methylimidazol-2-yl)-phenyl-methyl]butyramide Formula: C21H23N3O2S MolecularWeight: 381.49122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CCC(=O)NC(C2=CC=CC=C2)C3=NC=CN3C

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CCC(=O)NC(C2=CC=CC=C2)C3=NC=CN3C

InChI

InChI=1S/C21H23N3O2S/c1-14-13-17(15(2)27-14)18(25)9-10-19(26)23-20(16-7-5-4-6-8-16)21-22-11-12-24(21)3/h4-8,11-13,20H,9-10H2,1-3H3,(H,23,26)