ethyl 6-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 6-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 6-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]pyridine-3-carboxylate CAS Name: 6-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]pyridine-3-carboxylate Traditional Name: 6-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]nicotinic acid ethyl ester Formula: C16H18ClN3O4S2 MolecularWeight: 415.91482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H18ClN3O4S2/c1-2-24-16(21)12-3-5-14(18-11-12)19-7-9-20(10-8-19)26(22,23)15-6-4-13(17)25-15/h3-6,11H,2,7-10H2,1H3