N-[[4-(aminocarbonylamino)phenyl]methyl]-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[4-(aminocarbonylamino)phenyl]methyl]-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(4-ureidophenyl)methyl]piperidine-4-carboxamide CAS Name: N-[[4-(carbamoylamino)phenyl]methyl]-1-(3,4-dimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[4-(carbamoylamino)phenyl]methyl]-1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)sulfonyl-N-(4-ureidobenzyl)isonipecotamide Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)NC(=O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)NC(=O)N)C

InChI

InChI=1S/C22H28N4O4S/c1-15-3-8-20(13-16(15)2)31(29,30)26-11-9-18(10-12-26)21(27)24-14-17-4-6-19(7-5-17)25-22(23)28/h3-8,13,18H,9-12,14H2,1-2H3,(H,24,27)(H3,23,25,28)