N-[4-chloranyl-6-[(2,3-dimethylphenyl)amino]pyrimidin-2-yl]sulfanyl-N-(1-oxidanylpropan-2-yl)ethanamide

Systemtic Name: N-[4-chloranyl-6-[(2,3-dimethylphenyl)amino]pyrimidin-2-yl]sulfanyl-N-(1-oxidanylpropan-2-yl)ethanamide Openeye Name: N-[4-chloro-6-(2,3-dimethylanilino)pyrimidin-2-yl]sulfanyl-N-(2-hydroxy-1-methyl-ethyl)acetamide CAS Name: N-[[4-chloro-6-(2,3-dimethylanilino)-2-pyrimidinyl]thio]-N-(1-hydroxypropan-2-yl)acetamide IUPAC Name: N-[4-chloro-6-(2,3-dimethylanilino)pyrimidin-2-yl]sulfanyl-N-(1-hydroxypropan-2-yl)acetamide Traditional Name: N-[[4-chloro-6-(2,3-dimethylanilino)pyrimidin-2-yl]thio]-N-(2-hydroxy-1-methyl-ethyl)acetamide Formula: C17H21ClN4O2S MolecularWeight: 380.89224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=CC(=NC(=N2)SN(C(C)CO)C(=O)C)Cl)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=CC(=NC(=N2)SN(C(C)CO)C(=O)C)Cl)C

InChI

InChI=1S/C17H21ClN4O2S/c1-10-6-5-7-14(12(10)3)19-16-8-15(18)20-17(21-16)25-22(13(4)24)11(2)9-23/h5-8,11,23H,9H2,1-4H3,(H,19,20,21)