N-[(1R)-1-(4-methylphenyl)propyl]-2-(1H-perimidin-2-ylsulfanyl)ethanamide

Systemtic Name: N-[(1R)-1-(4-methylphenyl)propyl]-2-(1H-perimidin-2-ylsulfanyl)ethanamide Openeye Name: 2-(1H-perimidin-2-ylsulfanyl)-N-[(1R)-1-(p-tolyl)propyl]acetamide CAS Name: N-[(1R)-1-(4-methylphenyl)propyl]-2-(1H-perimidin-2-ylthio)acetamide IUPAC Name: N-[(1R)-1-(4-methylphenyl)propyl]-2-(1H-perimidin-2-ylsulfanyl)acetamide Traditional Name: 2-(1H-perimidin-2-ylthio)-N-[(1R)-1-(p-tolyl)propyl]acetamide Formula: C23H23N3OS MolecularWeight: 389.51322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C)NC(=O)CSC2=NC3=CC=CC4=C3C(=CC=C4)N2

Isomeric SMILES

CC[C@H](C1=CC=C(C=C1)C)NC(=O)CSC2=NC3=CC=CC4=C3C(=CC=C4)N2

InChI

InChI=1S/C23H23N3OS/c1-3-18(16-12-10-15(2)11-13-16)24-21(27)14-28-23-25-19-8-4-6-17-7-5-9-20(26-23)22(17)19/h4-13,18H,3,14H2,1-2H3,(H,24,27)(H,25,26)/t18-/m1/s1