N-cyclopropyl-3-[[4,5-dimethyl-6-[methyl-(phenylmethyl)amino]pyrimidin-2-yl]sulfanylmethyl]benzamide

Systemtic Name: N-cyclopropyl-3-[[4,5-dimethyl-6-[methyl-(phenylmethyl)amino]pyrimidin-2-yl]sulfanylmethyl]benzamide Openeye Name: 3-[[4-[benzyl(methyl)amino]-5,6-dimethyl-pyrimidin-2-yl]sulfanylmethyl]-N-cyclopropyl-benzamide CAS Name: N-cyclopropyl-3-[[[4,5-dimethyl-6-[methyl-(phenylmethyl)amino]-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: 3-[[4-[benzyl(methyl)amino]-5,6-dimethylpyrimidin-2-yl]sulfanylmethyl]-N-cyclopropylbenzamide Traditional Name: 3-[[[4-[benzyl(methyl)amino]-5,6-dimethyl-pyrimidin-2-yl]thio]methyl]-N-cyclopropyl-benzamide Formula: C25H28N4OS MolecularWeight: 432.58102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1N(C)CC2=CC=CC=C2)SCC3=CC=CC(=C3)C(=O)NC4CC4)C

Isomeric SMILES

CC1=C(N=C(N=C1N(C)CC2=CC=CC=C2)SCC3=CC=CC(=C3)C(=O)NC4CC4)C

InChI

InChI=1S/C25H28N4OS/c1-17-18(2)26-25(28-23(17)29(3)15-19-8-5-4-6-9-19)31-16-20-10-7-11-21(14-20)24(30)27-22-12-13-22/h4-11,14,22H,12-13,15-16H2,1-3H3,(H,27,30)