4-(5-butanoyl-3-chloranyl-pyridin-2-yl)-N-(5-chloranylthiophen-2-yl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: 4-(5-butanoyl-3-chloranyl-pyridin-2-yl)-N-(5-chloranylthiophen-2-yl)sulfonyl-piperazine-1-carboxamide Openeye Name: 4-(5-butanoyl-3-chloro-2-pyridyl)-N-[(5-chloro-2-thienyl)sulfonyl]piperazine-1-carboxamide CAS Name: 4-[3-chloro-5-(1-oxobutyl)-2-pyridinyl]-N-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinecarboxamide IUPAC Name: 4-(5-butanoyl-3-chloropyridin-2-yl)-N-(5-chlorothiophen-2-yl)sulfonylpiperazine-1-carboxamide Traditional Name: 4-(5-butyryl-3-chloro-2-pyridyl)-N-[(5-chloro-2-thienyl)sulfonyl]piperazine-1-carboxamide Formula: C18H20Cl2N4O4S2 MolecularWeight: 491.4118

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC(=C(N=C1)N2CCN(CC2)C(=O)NS(=O)(=O)C3=CC=C(S3)Cl)Cl

Isomeric SMILES

CCCC(=O)C1=CC(=C(N=C1)N2CCN(CC2)C(=O)NS(=O)(=O)C3=CC=C(S3)Cl)Cl

InChI

InChI=1S/C18H20Cl2N4O4S2/c1-2-3-14(25)12-10-13(19)17(21-11-12)23-6-8-24(9-7-23)18(26)22-30(27,28)16-5-4-15(20)29-16/h4-5,10-11H,2-3,6-9H2,1H3,(H,22,26)