4-(4-methylsulfonylphenyl)-N-(phenylmethyl)-6-propan-2-yl-pyrimidin-2-amine

Systemtic Name: 4-(4-methylsulfonylphenyl)-N-(phenylmethyl)-6-propan-2-yl-pyrimidin-2-amine Openeye Name: N-benzyl-4-isopropyl-6-(4-methylsulfonylphenyl)pyrimidin-2-amine CAS Name: 4-(4-methylsulfonylphenyl)-N-(phenylmethyl)-6-propan-2-yl-2-pyrimidinamine IUPAC Name: N-benzyl-4-(4-methylsulfonylphenyl)-6-propan-2-ylpyrimidin-2-amine Traditional Name: benzyl-[4-isopropyl-6-(4-mesylphenyl)pyrimidin-2-yl]amine Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NC(=C1)C2=CC=C(C=C2)S(=O)(=O)C)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=NC(=NC(=C1)C2=CC=C(C=C2)S(=O)(=O)C)NCC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O2S/c1-15(2)19-13-20(17-9-11-18(12-10-17)27(3,25)26)24-21(23-19)22-14-16-7-5-4-6-8-16/h4-13,15H,14H2,1-3H3,(H,22,23,24)