6-tert-butyl-2-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrimidin-4-amine

Systemtic Name: 6-tert-butyl-2-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrimidin-4-amine Openeye Name: 6-tert-butyl-2-(4-methylsulfonylphenyl)-N-(2-thienylmethyl)pyrimidin-4-amine CAS Name: 6-tert-butyl-2-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)-4-pyrimidinamine IUPAC Name: 6-tert-butyl-2-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrimidin-4-amine Traditional Name: [6-tert-butyl-2-(4-mesylphenyl)pyrimidin-4-yl]-(2-thenyl)amine Formula: C20H23N3O2S2 MolecularWeight: 401.54552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(=N1)C2=CC=C(C=C2)S(=O)(=O)C)NCC3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC(=NC(=N1)C2=CC=C(C=C2)S(=O)(=O)C)NCC3=CC=CS3

InChI

InChI=1S/C20H23N3O2S2/c1-20(2,3)17-12-18(21-13-15-6-5-11-26-15)23-19(22-17)14-7-9-16(10-8-14)27(4,24)25/h5-12H,13H2,1-4H3,(H,21,22,23)