N-(2-ethylphenyl)-1-[4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(2-ethylphenyl)-1-[4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonyl-piperidine-3-carboxamide Openeye Name: N-(2-ethylphenyl)-1-[4-(tetrazol-1-yl)phenyl]sulfonyl-piperidine-3-carboxamide CAS Name: N-(2-ethylphenyl)-1-[4-(1-tetrazolyl)phenyl]sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(2-ethylphenyl)-1-[4-(tetrazol-1-yl)phenyl]sulfonylpiperidine-3-carboxamide Traditional Name: N-(2-ethylphenyl)-1-[4-(tetrazol-1-yl)phenyl]sulfonyl-nipecotamide Formula: C21H24N6O3S MolecularWeight: 440.51866

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)N4C=NN=N4

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)N4C=NN=N4

InChI

InChI=1S/C21H24N6O3S/c1-2-16-6-3-4-8-20(16)23-21(28)17-7-5-13-26(14-17)31(29,30)19-11-9-18(10-12-19)27-15-22-24-25-27/h3-4,6,8-12,15,17H,2,5,7,13-14H2,1H3,(H,23,28)