(5-chloranyl-2-ethylsulfanyl-pyrimidin-4-yl)-(4-methylpiperazin-1-yl)methanone

Systemtic Name: (5-chloranyl-2-ethylsulfanyl-pyrimidin-4-yl)-(4-methylpiperazin-1-yl)methanone Openeye Name: (5-chloro-2-ethylsulfanyl-pyrimidin-4-yl)-(4-methylpiperazin-1-yl)methanone CAS Name: [5-chloro-2-(ethylthio)-4-pyrimidinyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: (5-chloro-2-ethylsulfanylpyrimidin-4-yl)-(4-methylpiperazin-1-yl)methanone Traditional Name: [5-chloro-2-(ethylthio)pyrimidin-4-yl]-(4-methylpiperazino)methanone Formula: C12H17ClN4OS MolecularWeight: 300.80758

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C(=N1)C(=O)N2CCN(CC2)C)Cl

Isomeric SMILES

CCSC1=NC=C(C(=N1)C(=O)N2CCN(CC2)C)Cl

InChI

InChI=1S/C12H17ClN4OS/c1-3-19-12-14-8-9(13)10(15-12)11(18)17-6-4-16(2)5-7-17/h8H,3-7H2,1-2H3