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

Systemtic Name: N-[4-(aminocarbonylamino)phenyl]-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)sulfonyl-N-(4-ureidophenyl)piperidine-4-carboxamide CAS Name: N-[4-(carbamoylamino)phenyl]-1-(3,4-dimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-(carbamoylamino)phenyl]-1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)sulfonyl-N-(4-ureidophenyl)isonipecotamide Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)NC(=O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)NC(=O)N)C

InChI

InChI=1S/C21H26N4O4S/c1-14-3-8-19(13-15(14)2)30(28,29)25-11-9-16(10-12-25)20(26)23-17-4-6-18(7-5-17)24-21(22)27/h3-8,13,16H,9-12H2,1-2H3,(H,23,26)(H3,22,24,27)