N-(2-methyl-6-propan-2-yl-phenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide

Systemtic Name: N-(2-methyl-6-propan-2-yl-phenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide Openeye Name: N-(2-isopropyl-6-methyl-phenyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide CAS Name: N-(2-methyl-6-propan-2-ylphenyl)-2-(1H-perimidin-2-ylthio)acetamide IUPAC Name: N-(2-methyl-6-propan-2-ylphenyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide Traditional Name: N-(2-isopropyl-6-methyl-phenyl)-2-(1H-perimidin-2-ylthio)acetamide Formula: C23H23N3OS MolecularWeight: 389.51322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)CSC2=NC3=CC=CC4=C3C(=CC=C4)N2

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)CSC2=NC3=CC=CC4=C3C(=CC=C4)N2

InChI

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