ethyl 1-[3-(2-phenylimino-3-propyl-1,3-thiazol-4-yl)phenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(2-phenylimino-3-propyl-1,3-thiazol-4-yl)phenyl]sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[3-(2-phenylimino-3-propyl-thiazol-4-yl)phenyl]sulfonylpiperidine-4-carboxylate CAS Name: 1-[3-(2-phenylimino-3-propyl-4-thiazolyl)phenyl]sulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(2-phenylimino-3-propyl-1,3-thiazol-4-yl)phenyl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-[3-(2-phenylimino-3-propyl-4-thiazolin-4-yl)phenyl]sulfonylisonipecotic acid ethyl ester Formula: C26H31N3O4S2 MolecularWeight: 513.67204

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CSC1=NC2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)N4CCC(CC4)C(=O)OCC

Isomeric SMILES

CCCN1C(=CSC1=NC2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)N4CCC(CC4)C(=O)OCC

InChI

InChI=1S/C26H31N3O4S2/c1-3-15-29-24(19-34-26(29)27-22-10-6-5-7-11-22)21-9-8-12-23(18-21)35(31,32)28-16-13-20(14-17-28)25(30)33-4-2/h5-12,18-20H,3-4,13-17H2,1-2H3