4-[(4-chlorophenyl)sulfinylmethyl]-6-piperidin-1-yl-2-pyridin-2-yl-pyrimidine

Systemtic Name: 4-[(4-chlorophenyl)sulfinylmethyl]-6-piperidin-1-yl-2-pyridin-2-yl-pyrimidine Openeye Name: 4-[(4-chlorophenyl)sulfinylmethyl]-6-(1-piperidyl)-2-(2-pyridyl)pyrimidine CAS Name: 4-[(4-chlorophenyl)sulfinylmethyl]-6-(1-piperidinyl)-2-(2-pyridinyl)pyrimidine IUPAC Name: 4-[(4-chlorophenyl)sulfinylmethyl]-6-piperidin-1-yl-2-pyridin-2-ylpyrimidine Traditional Name: 4-[(4-chlorophenyl)sulfinylmethyl]-6-piperidino-2-(2-pyridyl)pyrimidine Formula: C21H21ClN4OS MolecularWeight: 412.93564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=NC(=C2)CS(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=N4

Isomeric SMILES

C1CCN(CC1)C2=NC(=NC(=C2)CS(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=N4

InChI

InChI=1S/C21H21ClN4OS/c22-16-7-9-18(10-8-16)28(27)15-17-14-20(26-12-4-1-5-13-26)25-21(24-17)19-6-2-3-11-23-19/h2-3,6-11,14H,1,4-5,12-13,15H2