2-(1H-perimidin-2-ylsulfanyl)-N-[(2R)-4-phenylbutan-2-yl]ethanamide

Systemtic Name: 2-(1H-perimidin-2-ylsulfanyl)-N-[(2R)-4-phenylbutan-2-yl]ethanamide Openeye Name: N-[(1R)-1-methyl-3-phenyl-propyl]-2-(1H-perimidin-2-ylsulfanyl)acetamide CAS Name: 2-(1H-perimidin-2-ylthio)-N-[(2R)-4-phenylbutan-2-yl]acetamide IUPAC Name: 2-(1H-perimidin-2-ylsulfanyl)-N-[(2R)-4-phenylbutan-2-yl]acetamide Traditional Name: N-[(1R)-1-methyl-3-phenyl-propyl]-2-(1H-perimidin-2-ylthio)acetamide Formula: C23H23N3OS MolecularWeight: 389.51322

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)CSC2=NC3=CC=CC4=C3C(=CC=C4)N2

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC(=O)CSC2=NC3=CC=CC4=C3C(=CC=C4)N2

InChI

InChI=1S/C23H23N3OS/c1-16(13-14-17-7-3-2-4-8-17)24-21(27)15-28-23-25-19-11-5-9-18-10-6-12-20(26-23)22(18)19/h2-12,16H,13-15H2,1H3,(H,24,27)(H,25,26)/t16-/m1/s1