N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-methyl-butanamide

Systemtic Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-methyl-butanamide Openeye Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-methyl-butanamide CAS Name: N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]-3-methylbutanamide IUPAC Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-methylbutanamide Traditional Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]-3-methyl-butyramide Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)CC(C)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)CC(C)C)C

InChI

InChI=1S/C17H21N3OS/c1-11(2)9-16(21)20-14-5-7-15(8-6-14)22-17-18-12(3)10-13(4)19-17/h5-8,10-11H,9H2,1-4H3,(H,20,21)