N-(3-azanyl-3-oxidanylidene-propyl)-1-(3,4-dimethylphenyl)sulfonyl-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: N-(3-azanyl-3-oxidanylidene-propyl)-1-(3,4-dimethylphenyl)sulfonyl-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-(3-amino-3-oxo-propyl)-N-benzyl-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-amino-3-oxopropyl)-1-(3,4-dimethylphenyl)sulfonyl-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-(3-amino-3-oxopropyl)-N-benzyl-1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-amino-3-keto-propyl)-N-benzyl-1-(3,4-dimethylphenyl)sulfonyl-isonipecotamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(CCC(=O)N)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(CCC(=O)N)CC3=CC=CC=C3)C

InChI

InChI=1S/C24H31N3O4S/c1-18-8-9-22(16-19(18)2)32(30,31)27-14-10-21(11-15-27)24(29)26(13-12-23(25)28)17-20-6-4-3-5-7-20/h3-9,16,21H,10-15,17H2,1-2H3,(H2,25,28)