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

Systemtic Name: (5-chloranyl-2-ethylsulfanyl-pyrimidin-4-yl)-(4-phenylpiperazin-1-yl)methanone Openeye Name: (5-chloro-2-ethylsulfanyl-pyrimidin-4-yl)-(4-phenylpiperazin-1-yl)methanone CAS Name: [5-chloro-2-(ethylthio)-4-pyrimidinyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (5-chloro-2-ethylsulfanylpyrimidin-4-yl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: [5-chloro-2-(ethylthio)pyrimidin-4-yl]-(4-phenylpiperazino)methanone Formula: C17H19ClN4OS MolecularWeight: 362.87696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClN4OS/c1-2-24-17-19-12-14(18)15(20-17)16(23)22-10-8-21(9-11-22)13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3