2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-[[1-(3,5-dimethylphenyl)-2-imidazolyl]thio]-N-[2-methyl-4-(4-methyl-1-piperazinyl)phenyl]acetamide IUPAC Name: 2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-[[1-(3,5-dimethylphenyl)imidazol-2-yl]thio]-N-[2-methyl-4-(4-methylpiperazino)phenyl]acetamide Formula: C25H31N5OS MolecularWeight: 449.61154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CN=C2SCC(=O)NC3=C(C=C(C=C3)N4CCN(CC4)C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CN=C2SCC(=O)NC3=C(C=C(C=C3)N4CCN(CC4)C)C)C

InChI

InChI=1S/C25H31N5OS/c1-18-13-19(2)15-22(14-18)30-8-7-26-25(30)32-17-24(31)27-23-6-5-21(16-20(23)3)29-11-9-28(4)10-12-29/h5-8,13-16H,9-12,17H2,1-4H3,(H,27,31)