N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanamide

Systemtic Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanamide Openeye Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-4-(4-methylsulfanylphenyl)-4-oxo-butanamide CAS Name: N-[(1R)-1-[4-(1-imidazolyl)phenyl]ethyl]-4-[4-(methylthio)phenyl]-4-oxobutanamide IUPAC Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-4-(4-methylsulfanylphenyl)-4-oxobutanamide Traditional Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-4-keto-4-[4-(methylthio)phenyl]butyramide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)CCC(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)N2C=CN=C2)NC(=O)CCC(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C22H23N3O2S/c1-16(17-3-7-19(8-4-17)25-14-13-23-15-25)24-22(27)12-11-21(26)18-5-9-20(28-2)10-6-18/h3-10,13-16H,11-12H2,1-2H3,(H,24,27)/t16-/m1/s1