N-[[4-(aminocarbonylamino)phenyl]methyl]-1-(2,5-dimethylphenyl)sulfonyl-cyclopentane-1-carboxamide

Systemtic Name: N-[[4-(aminocarbonylamino)phenyl]methyl]-1-(2,5-dimethylphenyl)sulfonyl-cyclopentane-1-carboxamide Openeye Name: 1-(2,5-dimethylphenyl)sulfonyl-N-[(4-ureidophenyl)methyl]cyclopentanecarboxamide CAS Name: N-[[4-(carbamoylamino)phenyl]methyl]-1-(2,5-dimethylphenyl)sulfonyl-1-cyclopentanecarboxamide IUPAC Name: N-[[4-(carbamoylamino)phenyl]methyl]-1-(2,5-dimethylphenyl)sulfonylcyclopentane-1-carboxamide Traditional Name: 1-(2,5-dimethylphenyl)sulfonyl-N-(4-ureidobenzyl)cyclopentanecarboxamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)C2(CCCC2)C(=O)NCC3=CC=C(C=C3)NC(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)C2(CCCC2)C(=O)NCC3=CC=C(C=C3)NC(=O)N

InChI

InChI=1S/C22H27N3O4S/c1-15-5-6-16(2)19(13-15)30(28,29)22(11-3-4-12-22)20(26)24-14-17-7-9-18(10-8-17)25-21(23)27/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,24,26)(H3,23,25,27)