N-(2,3-dimethylphenyl)-2-methylsulfanyl-4-propyl-pyrimidine-5-carboxamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-methylsulfanyl-4-propyl-pyrimidine-5-carboxamide Openeye Name: N-(2,3-dimethylphenyl)-2-methylsulfanyl-4-propyl-pyrimidine-5-carboxamide CAS Name: N-(2,3-dimethylphenyl)-2-(methylthio)-4-propyl-5-pyrimidinecarboxamide IUPAC Name: N-(2,3-dimethylphenyl)-2-methylsulfanyl-4-propylpyrimidine-5-carboxamide Traditional Name: N-(2,3-dimethylphenyl)-2-(methylthio)-4-propyl-pyrimidine-5-carboxamide Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NC=C1C(=O)NC2=CC=CC(=C2C)C)SC

Isomeric SMILES

CCCC1=NC(=NC=C1C(=O)NC2=CC=CC(=C2C)C)SC

InChI

InChI=1S/C17H21N3OS/c1-5-7-15-13(10-18-17(20-15)22-4)16(21)19-14-9-6-8-11(2)12(14)3/h6,8-10H,5,7H2,1-4H3,(H,19,21)