2-[[1-(2-carbamothioylpyridin-4-yl)piperidin-4-yl]methylamino]-N-(5-chloranylpyridin-2-yl)benzamide

Systemtic Name: 2-[[1-(2-carbamothioylpyridin-4-yl)piperidin-4-yl]methylamino]-N-(5-chloranylpyridin-2-yl)benzamide Openeye Name: 2-[[1-(2-carbamothioyl-4-pyridyl)-4-piperidyl]methylamino]-N-(5-chloro-2-pyridyl)benzamide CAS Name: 2-[[1-(2-carbamothioyl-4-pyridinyl)-4-piperidinyl]methylamino]-N-(5-chloro-2-pyridinyl)benzamide IUPAC Name: 2-[[1-(2-carbamothioylpyridin-4-yl)piperidin-4-yl]methylamino]-N-(5-chloropyridin-2-yl)benzamide Traditional Name: N-(5-chloro-2-pyridyl)-2-[[1-(2-thiocarbamoyl-4-pyridyl)-4-piperidyl]methylamino]benzamide Formula: C24H25ClN6OS MolecularWeight: 481.0129

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC2=CC=CC=C2C(=O)NC3=NC=C(C=C3)Cl)C4=CC(=NC=C4)C(=S)N

Isomeric SMILES

C1CN(CCC1CNC2=CC=CC=C2C(=O)NC3=NC=C(C=C3)Cl)C4=CC(=NC=C4)C(=S)N

InChI

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