N-[4-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]carbonylphenyl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]carbonylphenyl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[4-[4-[(4-cyanophenyl)methyl]piperazine-1-carbonyl]phenyl]-2-(1-methylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[4-[[4-[(4-cyanophenyl)methyl]-1-piperazinyl]-oxomethyl]phenyl]-2-[(1-methyl-2-imidazolyl)thio]acetamide IUPAC Name: N-[4-[4-[(4-cyanophenyl)methyl]piperazine-1-carbonyl]phenyl]-2-(1-methylimidazol-2-yl)sulfanylacetamide Traditional Name: N-[4-[4-(4-cyanobenzyl)piperazine-1-carbonyl]phenyl]-2-[(1-methylimidazol-2-yl)thio]acetamide Formula: C25H26N6O2S MolecularWeight: 474.57794

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H26N6O2S/c1-29-11-10-27-25(29)34-18-23(32)28-22-8-6-21(7-9-22)24(33)31-14-12-30(13-15-31)17-20-4-2-19(16-26)3-5-20/h2-11H,12-15,17-18H2,1H3,(H,28,32)