4-(4-methyl-6-phenylazanyl-pyrimidin-2-yl)sulfanylbutan-2-one

Systemtic Name: 4-(4-methyl-6-phenylazanyl-pyrimidin-2-yl)sulfanylbutan-2-one Openeye Name: 4-(4-anilino-6-methyl-pyrimidin-2-yl)sulfanylbutan-2-one CAS Name: 4-[(4-anilino-6-methyl-2-pyrimidinyl)thio]-2-butanone IUPAC Name: 4-(4-anilino-6-methylpyrimidin-2-yl)sulfanylbutan-2-one Traditional Name: 4-[(4-anilino-6-methyl-pyrimidin-2-yl)thio]butan-2-one Formula: C15H17N3OS MolecularWeight: 287.37998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCCC(=O)C)NC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=NC(=N1)SCCC(=O)C)NC2=CC=CC=C2

InChI

InChI=1S/C15H17N3OS/c1-11-10-14(17-13-6-4-3-5-7-13)18-15(16-11)20-9-8-12(2)19/h3-7,10H,8-9H2,1-2H3,(H,16,17,18)