2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-(3-methylphenyl)-N-(phenylmethyl)ethanamide

Systemtic Name: 2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-(3-methylphenyl)-N-(phenylmethyl)ethanamide Openeye Name: 2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-N-benzyl-N-(m-tolyl)acetamide CAS Name: 2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-N-(3-methylphenyl)-N-(phenylmethyl)acetamide IUPAC Name: 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-benzyl-N-(3-methylphenyl)acetamide Traditional Name: 2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]-N-benzyl-N-(m-tolyl)acetamide Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC2=CC=CC=C2)C(=O)CSC3=NC(=CC(=N3)N)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CC2=CC=CC=C2)C(=O)CSC3=NC(=CC(=N3)N)C

InChI

InChI=1S/C21H22N4OS/c1-15-7-6-10-18(11-15)25(13-17-8-4-3-5-9-17)20(26)14-27-21-23-16(2)12-19(22)24-21/h3-12H,13-14H2,1-2H3,(H2,22,23,24)