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

Systemtic Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(4,5-dimethylthiazol-2-yl)-3-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(4,5-dimethyl-2-thiazolyl)-3-[(6-phenyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(6-phenylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(4,5-dimethylthiazol-2-yl)-3-[(6-phenylpyrimidin-4-yl)thio]propionamide Formula: C18H18N4OS2 MolecularWeight: 370.49172

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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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4OS2/c1-12-13(2)25-18(21-12)22-16(23)8-9-24-17-10-15(19-11-20-17)14-6-4-3-5-7-14/h3-7,10-11H,8-9H2,1-2H3,(H,21,22,23)