(5-chloranyl-2-ethylsulfanyl-pyrimidin-4-yl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: (5-chloranyl-2-ethylsulfanyl-pyrimidin-4-yl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: (5-chloro-2-ethylsulfanyl-pyrimidin-4-yl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [5-chloro-2-(ethylthio)-4-pyrimidinyl]-[4-(2-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: (5-chloro-2-ethylsulfanylpyrimidin-4-yl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [5-chloro-2-(ethylthio)pyrimidin-4-yl]-[4-(2-methoxyphenyl)piperazino]methanone Formula: C18H21ClN4O2S MolecularWeight: 392.90294

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C(=N1)C(=O)N2CCN(CC2)C3=CC=CC=C3OC)Cl

Isomeric SMILES

CCSC1=NC=C(C(=N1)C(=O)N2CCN(CC2)C3=CC=CC=C3OC)Cl

InChI

InChI=1S/C18H21ClN4O2S/c1-3-26-18-20-12-13(19)16(21-18)17(24)23-10-8-22(9-11-23)14-6-4-5-7-15(14)25-2/h4-7,12H,3,8-11H2,1-2H3