2-[(2-carbamothioylpyridin-4-yl)methyl-piperidin-4-yl-amino]-N-(5-chloranylpyridin-2-yl)benzamide

Systemtic Name: 2-[(2-carbamothioylpyridin-4-yl)methyl-piperidin-4-yl-amino]-N-(5-chloranylpyridin-2-yl)benzamide Openeye Name: 2-[(2-carbamothioyl-4-pyridyl)methyl-(4-piperidyl)amino]-N-(5-chloro-2-pyridyl)benzamide CAS Name: 2-[(2-carbamothioyl-4-pyridinyl)methyl-(4-piperidinyl)amino]-N-(5-chloro-2-pyridinyl)benzamide IUPAC Name: 2-[(2-carbamothioylpyridin-4-yl)methyl-piperidin-4-ylamino]-N-(5-chloropyridin-2-yl)benzamide Traditional Name: N-(5-chloro-2-pyridyl)-2-[4-piperidyl-[(2-thiocarbamoyl-4-pyridyl)methyl]amino]benzamide Formula: C24H25ClN6OS MolecularWeight: 481.0129

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N(CC2=CC(=NC=C2)C(=S)N)C3=CC=CC=C3C(=O)NC4=NC=C(C=C4)Cl

Isomeric SMILES

C1CNCCC1N(CC2=CC(=NC=C2)C(=S)N)C3=CC=CC=C3C(=O)NC4=NC=C(C=C4)Cl

InChI

InChI=1S/C24H25ClN6OS/c25-17-5-6-22(29-14-17)30-24(32)19-3-1-2-4-21(19)31(18-8-10-27-11-9-18)15-16-7-12-28-20(13-16)23(26)33/h1-7,12-14,18,27H,8-11,15H2,(H2,26,33)(H,29,30,32)