4-[3-[(4-cyanophenyl)-sulfino-amino]phenyl]carbonyl-1-methyl-piperidine

Systemtic Name: 4-[3-[(4-cyanophenyl)-sulfino-amino]phenyl]carbonyl-1-methyl-piperidine Openeye Name: 4-[3-(4-cyano-N-sulfino-anilino)benzoyl]-1-methyl-piperidine CAS Name: 4-[[3-(4-cyano-N-sulfinoanilino)phenyl]-oxomethyl]-1-methylpiperidine IUPAC Name: 4-[3-(4-cyano-N-sulfinoanilino)benzoyl]-1-methylpiperidine Traditional Name: 4-[3-(4-cyano-N-sulfino-anilino)benzoyl]-1-methyl-piperidine Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C(=O)C2=CC(=CC=C2)N(C3=CC=C(C=C3)C#N)S(=O)O

Isomeric SMILES

CN1CCC(CC1)C(=O)C2=CC(=CC=C2)N(C3=CC=C(C=C3)C#N)S(=O)O

InChI

InChI=1S/C20H21N3O3S/c1-22-11-9-16(10-12-22)20(24)17-3-2-4-19(13-17)23(27(25)26)18-7-5-15(14-21)6-8-18/h2-8,13,16H,9-12H2,1H3,(H,25,26)