2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethanone CAS Name: 2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-1-[4-(2,3-dimethylphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]-1-[4-(2,3-dimethylphenyl)piperazino]ethanone Formula: C19H25N5OS MolecularWeight: 371.4997

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CSC3=NC(=CC(=N3)N)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CSC3=NC(=CC(=N3)N)C)C

InChI

InChI=1S/C19H25N5OS/c1-13-5-4-6-16(15(13)3)23-7-9-24(10-8-23)18(25)12-26-19-21-14(2)11-17(20)22-19/h4-6,11H,7-10,12H2,1-3H3,(H2,20,21,22)