(3R)-N-[(4-methylcyclohexylidene)amino]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3R)-N-[(4-methylcyclohexylidene)amino]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3R)-N-[(4-methylcyclohexylidene)amino]-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: (3R)-N-[(4-methylcyclohexylidene)amino]-1-(4-methylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3R)-N-[(4-methylcyclohexylidene)amino]-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3R)-N-[(4-methylcyclohexylidene)amino]-1-tosyl-nipecotamide Formula: C20H29N3O3S MolecularWeight: 391.52756

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=NNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)C)CC1

Isomeric SMILES

CC1CCC(=NNC(=O)[C@@H]2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)C)CC1

InChI

InChI=1S/C20H29N3O3S/c1-15-5-9-18(10-6-15)21-22-20(24)17-4-3-13-23(14-17)27(25,26)19-11-7-16(2)8-12-19/h7-8,11-12,15,17H,3-6,9-10,13-14H2,1-2H3,(H,22,24)/t15?,17-/m1/s1