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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)N3C=NN=N3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)N3C=NN=N3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C21H24N6O3S/c28-21(22-13-12-17-5-2-1-3-6-17)18-7-4-14-26(15-18)31(29,30)20-10-8-19(9-11-20)27-16-23-24-25-27/h1-3,5-6,8-11,16,18H,4,7,12-15H2,(H,22,28)