(2S)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)butanamide

Systemtic Name: (2S)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)butanamide Openeye Name: (2S)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-thiazol-2-yl-butanamide CAS Name: (2S)-2-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]-N-(2-thiazolyl)butanamide IUPAC Name: (2S)-2-(2-methyl-6-phenylpyrimidin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)butanamide Traditional Name: (2S)-2-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]-N-thiazol-2-yl-butyramide Formula: C18H18N4OS2 MolecularWeight: 370.49172

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC=CS1)SC2=NC(=NC(=C2)C3=CC=CC=C3)C

Isomeric SMILES

CC[C@@H](C(=O)NC1=NC=CS1)SC2=NC(=NC(=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C18H18N4OS2/c1-3-15(17(23)22-18-19-9-10-24-18)25-16-11-14(20-12(2)21-16)13-7-5-4-6-8-13/h4-11,15H,3H2,1-2H3,(H,19,22,23)/t15-/m0/s1