2-azanyl-2-[4-(5-chloranylpyridin-2-yl)piperazin-1-yl]sulfonyl-3-pyridin-2-ylsulfanyl-propanamide

Systemtic Name: 2-azanyl-2-[4-(5-chloranylpyridin-2-yl)piperazin-1-yl]sulfonyl-3-pyridin-2-ylsulfanyl-propanamide Openeye Name: 2-amino-2-[4-(5-chloro-2-pyridyl)piperazin-1-yl]sulfonyl-3-(2-pyridylsulfanyl)propanamide CAS Name: 2-amino-2-[[4-(5-chloro-2-pyridinyl)-1-piperazinyl]sulfonyl]-3-(2-pyridinylthio)propanamide IUPAC Name: 2-amino-2-[4-(5-chloropyridin-2-yl)piperazin-1-yl]sulfonyl-3-pyridin-2-ylsulfanylpropanamide Traditional Name: 2-amino-2-[4-(5-chloro-2-pyridyl)piperazino]sulfonyl-3-(2-pyridylthio)propionamide Formula: C17H21ClN6O3S2 MolecularWeight: 456.97004

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)Cl)S(=O)(=O)C(CSC3=CC=CC=N3)(C(=O)N)N

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)Cl)S(=O)(=O)C(CSC3=CC=CC=N3)(C(=O)N)N

InChI

InChI=1S/C17H21ClN6O3S2/c18-13-4-5-14(22-11-13)23-7-9-24(10-8-23)29(26,27)17(20,16(19)25)12-28-15-3-1-2-6-21-15/h1-6,11H,7-10,12,20H2,(H2,19,25)