N-(3,5-dimethylphenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide

Systemtic Name: N-(3,5-dimethylphenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide Openeye Name: N-(3,5-dimethylphenyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide CAS Name: N-(3,5-dimethylphenyl)-2-(1H-perimidin-2-ylthio)acetamide IUPAC Name: N-(3,5-dimethylphenyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide Traditional Name: N-(3,5-dimethylphenyl)-2-(1H-perimidin-2-ylthio)acetamide Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19N3OS/c1-13-9-14(2)11-16(10-13)22-19(25)12-26-21-23-17-7-3-5-15-6-4-8-18(24-21)20(15)17/h3-11H,12H2,1-2H3,(H,22,25)(H,23,24)