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

Systemtic Name: N-[(2R)-pentan-2-yl]-2-(1H-perimidin-2-ylsulfanyl)ethanamide Openeye Name: N-[(1R)-1-methylbutyl]-2-(1H-perimidin-2-ylsulfanyl)acetamide CAS Name: N-[(2R)-pentan-2-yl]-2-(1H-perimidin-2-ylthio)acetamide IUPAC Name: N-[(2R)-pentan-2-yl]-2-(1H-perimidin-2-ylsulfanyl)acetamide Traditional Name: N-[(1R)-1-methylbutyl]-2-(1H-perimidin-2-ylthio)acetamide Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)CSC1=NC2=CC=CC3=C2C(=CC=C3)N1

Isomeric SMILES

CCC[C@@H](C)NC(=O)CSC1=NC2=CC=CC3=C2C(=CC=C3)N1

InChI

InChI=1S/C18H21N3OS/c1-3-6-12(2)19-16(22)11-23-18-20-14-9-4-7-13-8-5-10-15(21-18)17(13)14/h4-5,7-10,12H,3,6,11H2,1-2H3,(H,19,22)(H,20,21)/t12-/m1/s1