5-chloranyl-2-ethylsulfanyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-ethylsulfanyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-ethylsulfanyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide CAS Name: 5-chloro-2-(ethylthio)-N-(4-methyl-1-piperazinyl)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-ethylsulfanyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(ethylthio)-N-(4-methylpiperazino)pyrimidine-4-carboxamide Formula: C12H18ClN5OS MolecularWeight: 315.82222

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C(=N1)C(=O)NN2CCN(CC2)C)Cl

Isomeric SMILES

CCSC1=NC=C(C(=N1)C(=O)NN2CCN(CC2)C)Cl

InChI

InChI=1S/C12H18ClN5OS/c1-3-20-12-14-8-9(13)10(15-12)11(19)16-18-6-4-17(2)5-7-18/h8H,3-7H2,1-2H3,(H,16,19)