N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-2-(1-propylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-2-(1-propylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(1-propylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-2-[(1-propyl-2-imidazolyl)thio]acetamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(1-propylimidazol-2-yl)sulfanylacetamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-2-[(1-propylimidazol-2-yl)thio]acetamide Formula: C25H31N5OS MolecularWeight: 449.61154

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCCN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H31N5OS/c1-2-13-30-14-12-26-25(30)32-20-24(31)27-22-8-10-23(11-9-22)29-17-15-28(16-18-29)19-21-6-4-3-5-7-21/h3-12,14H,2,13,15-20H2,1H3,(H,27,31)