5-chloranyl-N-(2,6-dimethylphenyl)-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-(2,6-dimethylphenyl)-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-(2,6-dimethylphenyl)-2-isopropylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(2,6-dimethylphenyl)-2-(propan-2-ylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-(2,6-dimethylphenyl)-2-propan-2-ylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-(2,6-dimethylphenyl)-2-(isopropylthio)pyrimidine-4-carboxamide Formula: C16H18ClN3OS MolecularWeight: 335.85162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C2=NC(=NC=C2Cl)SC(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C2=NC(=NC=C2Cl)SC(C)C

InChI

InChI=1S/C16H18ClN3OS/c1-9(2)22-16-18-8-12(17)14(20-16)15(21)19-13-10(3)6-5-7-11(13)4/h5-9H,1-4H3,(H,19,21)