2-chloranyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[(6-piperidin-1-ylpyridin-3-yl)amino]butan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[(6-piperidin-1-ylpyridin-3-yl)amino]butan-2-yl]benzamide Openeye Name: 2-chloro-N-[3-methylsulfanyl-1-[[6-(1-piperidyl)-3-pyridyl]carbamoyl]propyl]benzamide CAS Name: 2-chloro-N-[4-(methylthio)-1-oxo-1-[[6-(1-piperidinyl)-3-pyridinyl]amino]butan-2-yl]benzamide IUPAC Name: 2-chloro-N-[4-methylsulfanyl-1-oxo-1-[(6-piperidin-1-ylpyridin-3-yl)amino]butan-2-yl]benzamide Traditional Name: 2-chloro-N-[3-(methylthio)-1-[(6-piperidino-3-pyridyl)carbamoyl]propyl]benzamide Formula: C22H27ClN4O2S MolecularWeight: 446.99338

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CN=C(C=C1)N2CCCCC2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CSCCC(C(=O)NC1=CN=C(C=C1)N2CCCCC2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H27ClN4O2S/c1-30-14-11-19(26-21(28)17-7-3-4-8-18(17)23)22(29)25-16-9-10-20(24-15-16)27-12-5-2-6-13-27/h3-4,7-10,15,19H,2,5-6,11-14H2,1H3,(H,25,29)(H,26,28)