2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-phenyl-butanamide

Systemtic Name: 2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-phenyl-butanamide Openeye Name: 2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-phenyl-butanamide CAS Name: 2-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]-N-phenylbutanamide IUPAC Name: 2-(2-methyl-6-phenylpyrimidin-4-yl)sulfanyl-N-phenylbutanamide Traditional Name: 2-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]-N-phenyl-butyramide Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)SC2=NC(=NC(=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1)SC2=NC(=NC(=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H21N3OS/c1-3-19(21(25)24-17-12-8-5-9-13-17)26-20-14-18(22-15(2)23-20)16-10-6-4-7-11-16/h4-14,19H,3H2,1-2H3,(H,24,25)