(3S)-N'-(4-butoxy-3-methoxy-phenyl)carbonyl-1-thiophen-2-ylsulfonyl-piperidine-3-carbohydrazide

Systemtic Name: (3S)-N'-(4-butoxy-3-methoxy-phenyl)carbonyl-1-thiophen-2-ylsulfonyl-piperidine-3-carbohydrazide Openeye Name: (3S)-N'-(4-butoxy-3-methoxy-benzoyl)-1-(2-thienylsulfonyl)piperidine-3-carbohydrazide CAS Name: (3S)-N'-[(4-butoxy-3-methoxyphenyl)-oxomethyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarbohydrazide IUPAC Name: (3S)-N'-(4-butoxy-3-methoxybenzoyl)-1-thiophen-2-ylsulfonylpiperidine-3-carbohydrazide Traditional Name: (3S)-N'-(4-butoxy-3-methoxy-benzoyl)-1-(2-thienylsulfonyl)nipecotohydrazide Formula: C22H29N3O6S2 MolecularWeight: 495.61216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NNC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CS3)OC

InChI

InChI=1S/C22H29N3O6S2/c1-3-4-12-31-18-10-9-16(14-19(18)30-2)21(26)23-24-22(27)17-7-5-11-25(15-17)33(28,29)20-8-6-13-32-20/h6,8-10,13-14,17H,3-5,7,11-12,15H2,1-2H3,(H,23,26)(H,24,27)/t17-/m0/s1