5-chloranyl-2-methylsulfanyl-N-[1-(phenylcarbamoyl)piperidin-4-yl]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-methylsulfanyl-N-[1-(phenylcarbamoyl)piperidin-4-yl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-methylsulfanyl-N-[1-(phenylcarbamoyl)-4-piperidyl]pyrimidine-4-carboxamide CAS Name: N-[1-[anilino(oxo)methyl]-4-piperidinyl]-5-chloro-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-methylsulfanyl-N-[1-(phenylcarbamoyl)piperidin-4-yl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(methylthio)-N-[1-(phenylcarbamoyl)-4-piperidyl]pyrimidine-4-carboxamide Formula: C18H20ClN5O2S MolecularWeight: 405.9017

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NC2CCN(CC2)C(=O)NC3=CC=CC=C3)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NC2CCN(CC2)C(=O)NC3=CC=CC=C3)Cl

InChI

InChI=1S/C18H20ClN5O2S/c1-27-17-20-11-14(19)15(23-17)16(25)21-13-7-9-24(10-8-13)18(26)22-12-5-3-2-4-6-12/h2-6,11,13H,7-10H2,1H3,(H,21,25)(H,22,26)