[4-(2,5-dimethylphenyl)piperazin-1-yl]-(4-ethyl-2-methylsulfanyl-pyrimidin-5-yl)methanone

Systemtic Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-(4-ethyl-2-methylsulfanyl-pyrimidin-5-yl)methanone Openeye Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-(4-ethyl-2-methylsulfanyl-pyrimidin-5-yl)methanone CAS Name: [4-(2,5-dimethylphenyl)-1-piperazinyl]-[4-ethyl-2-(methylthio)-5-pyrimidinyl]methanone IUPAC Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-(4-ethyl-2-methylsulfanylpyrimidin-5-yl)methanone Traditional Name: [4-(2,5-dimethylphenyl)piperazino]-[4-ethyl-2-(methylthio)pyrimidin-5-yl]methanone Formula: C20H26N4OS MolecularWeight: 370.51164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NC=C1C(=O)N2CCN(CC2)C3=C(C=CC(=C3)C)C)SC

Isomeric SMILES

CCC1=NC(=NC=C1C(=O)N2CCN(CC2)C3=C(C=CC(=C3)C)C)SC

InChI

InChI=1S/C20H26N4OS/c1-5-17-16(13-21-20(22-17)26-4)19(25)24-10-8-23(9-11-24)18-12-14(2)6-7-15(18)3/h6-7,12-13H,5,8-11H2,1-4H3