2-(4-methylsulfonylphenyl)-N4-propan-2-yl-N6-(thiophen-2-ylmethyl)pyrimidine-4,6-diamine

Systemtic Name: 2-(4-methylsulfonylphenyl)-N4-propan-2-yl-N6-(thiophen-2-ylmethyl)pyrimidine-4,6-diamine Openeye Name: N4-isopropyl-2-(4-methylsulfonylphenyl)-N6-(2-thienylmethyl)pyrimidine-4,6-diamine CAS Name: 2-(4-methylsulfonylphenyl)-N4-propan-2-yl-N6-(thiophen-2-ylmethyl)pyrimidine-4,6-diamine IUPAC Name: 2-(4-methylsulfonylphenyl)-4-N-propan-2-yl-6-N-(thiophen-2-ylmethyl)pyrimidine-4,6-diamine Traditional Name: isopropyl-[2-(4-mesylphenyl)-6-(2-thenylamino)pyrimidin-4-yl]amine Formula: C19H22N4O2S2 MolecularWeight: 402.53358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC(=NC(=C1)NCC2=CC=CS2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)NC1=NC(=NC(=C1)NCC2=CC=CS2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C19H22N4O2S2/c1-13(2)21-18-11-17(20-12-15-5-4-10-26-15)22-19(23-18)14-6-8-16(9-7-14)27(3,24)25/h4-11,13H,12H2,1-3H3,(H2,20,21,22,23)