N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(4,5-dimethylthiazol-2-yl)-3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(4,5-dimethyl-2-thiazolyl)-3-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(2-methyl-6-phenylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(4,5-dimethylthiazol-2-yl)-3-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]propionamide Formula: C19H20N4OS2 MolecularWeight: 384.5183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CCSC2=NC(=NC(=C2)C3=CC=CC=C3)C)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CCSC2=NC(=NC(=C2)C3=CC=CC=C3)C)C

InChI

InChI=1S/C19H20N4OS2/c1-12-13(2)26-19(20-12)23-17(24)9-10-25-18-11-16(21-14(3)22-18)15-7-5-4-6-8-15/h4-8,11H,9-10H2,1-3H3,(H,20,23,24)