N-(3,4-dimethylphenyl)-3-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-(3,4-dimethylphenyl)-3-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-(3,4-dimethylphenyl)-3-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-(3,4-dimethylphenyl)-3-(2-pyrimidinylthio)propanamide IUPAC Name: N-(3,4-dimethylphenyl)-3-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-(3,4-dimethylphenyl)-3-(2-pyrimidylthio)propionamide Formula: C15H17N3OS MolecularWeight: 287.37998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCSC2=NC=CC=N2)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCSC2=NC=CC=N2)C

InChI

InChI=1S/C15H17N3OS/c1-11-4-5-13(10-12(11)2)18-14(19)6-9-20-15-16-7-3-8-17-15/h3-5,7-8,10H,6,9H2,1-2H3,(H,18,19)