6-(1-methoxypropan-2-ylamino)-N-(1-methylpyrazol-3-yl)-2-(4-methylsulfonylphenoxy)pyrimidine-4-carboxamide

Systemtic Name: 6-(1-methoxypropan-2-ylamino)-N-(1-methylpyrazol-3-yl)-2-(4-methylsulfonylphenoxy)pyrimidine-4-carboxamide Openeye Name: 6-[(2-methoxy-1-methyl-ethyl)amino]-N-(1-methylpyrazol-3-yl)-2-(4-methylsulfonylphenoxy)pyrimidine-4-carboxamide CAS Name: 6-(1-methoxypropan-2-ylamino)-N-(1-methyl-3-pyrazolyl)-2-(4-methylsulfonylphenoxy)-4-pyrimidinecarboxamide IUPAC Name: 6-(1-methoxypropan-2-ylamino)-N-(1-methylpyrazol-3-yl)-2-(4-methylsulfonylphenoxy)pyrimidine-4-carboxamide Traditional Name: 2-(4-mesylphenoxy)-6-[(2-methoxy-1-methyl-ethyl)amino]-N-(1-methylpyrazol-3-yl)pyrimidine-4-carboxamide Formula: C20H24N6O5S MolecularWeight: 460.50676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC1=NC(=NC(=C1)C(=O)NC2=NN(C=C2)C)OC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(COC)NC1=NC(=NC(=C1)C(=O)NC2=NN(C=C2)C)OC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H24N6O5S/c1-13(12-30-3)21-18-11-16(19(27)23-17-9-10-26(2)25-17)22-20(24-18)31-14-5-7-15(8-6-14)32(4,28)29/h5-11,13H,12H2,1-4H3,(H,21,22,24)(H,23,25,27)