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

Systemtic Name: 6-cyclopentyloxy-2-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrimidin-4-amine Openeye Name: 6-(cyclopentoxy)-2-(4-methylsulfonylphenyl)-N-(2-thienylmethyl)pyrimidin-4-amine CAS Name: 6-cyclopentyloxy-2-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)-4-pyrimidinamine IUPAC Name: 6-cyclopentyloxy-2-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrimidin-4-amine Traditional Name: [6-(cyclopentoxy)-2-(4-mesylphenyl)pyrimidin-4-yl]-(2-thenyl)amine Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=NC(=CC(=N2)OC3CCCC3)NCC4=CC=CS4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=NC(=CC(=N2)OC3CCCC3)NCC4=CC=CS4

InChI

InChI=1S/C21H23N3O3S2/c1-29(25,26)18-10-8-15(9-11-18)21-23-19(22-14-17-7-4-12-28-17)13-20(24-21)27-16-5-2-3-6-16/h4,7-13,16H,2-3,5-6,14H2,1H3,(H,22,23,24)