ethyl 2-chloranyl-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridine-3-carboxylate

Systemtic Name: ethyl 2-chloranyl-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridine-3-carboxylate Openeye Name: ethyl 2-chloro-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridine-3-carboxylate CAS Name: 2-chloro-5-[(4-ethyl-1-piperazinyl)sulfonyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylpyridine-3-carboxylate Traditional Name: 2-chloro-5-(4-ethylpiperazino)sulfonyl-nicotinic acid ethyl ester Formula: C14H20ClN3O4S MolecularWeight: 361.8443

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CN=C(C(=C2)C(=O)OCC)Cl

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CN=C(C(=C2)C(=O)OCC)Cl

InChI

InChI=1S/C14H20ClN3O4S/c1-3-17-5-7-18(8-6-17)23(20,21)11-9-12(13(15)16-10-11)14(19)22-4-2/h9-10H,3-8H2,1-2H3