4-(2,5-dimethylthiophen-3-yl)-N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-4-oxidanylidene-butanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CCC(=O)NC(C)C2=CC=C(C=C2)N3C=CN=C3

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CCC(=O)N[C@@H](C)C2=CC=C(C=C2)N3C=CN=C3

InChI

InChI=1S/C21H23N3O2S/c1-14-12-19(16(3)27-14)20(25)8-9-21(26)23-15(2)17-4-6-18(7-5-17)24-11-10-22-13-24/h4-7,10-13,15H,8-9H2,1-3H3,(H,23,26)/t15-/m0/s1