N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide

Systemtic Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Openeye Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-1-methylsulfonyl-indoline-5-carboxamide CAS Name: N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide IUPAC Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Traditional Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]-1-mesyl-indoline-5-carboxamide Formula: C22H22N4O3S2 MolecularWeight: 454.56508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)N(CC4)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)N(CC4)S(=O)(=O)C)C

InChI

InChI=1S/C22H22N4O3S2/c1-14-12-15(2)24-22(23-14)30-19-7-5-18(6-8-19)25-21(27)17-4-9-20-16(13-17)10-11-26(20)31(3,28)29/h4-9,12-13H,10-11H2,1-3H3,(H,25,27)