4-[4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-yl]carbonyl-N-prop-2-ynyl-benzenesulfonamide

Systemtic Name: 4-[4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-yl]carbonyl-N-prop-2-ynyl-benzenesulfonamide Openeye Name: 4-[4-(1-phenyltetrazol-5-yl)piperazine-1-carbonyl]-N-prop-2-ynyl-benzenesulfonamide CAS Name: 4-[oxo-[4-(1-phenyl-5-tetrazolyl)-1-piperazinyl]methyl]-N-prop-2-ynylbenzenesulfonamide IUPAC Name: 4-[4-(1-phenyltetrazol-5-yl)piperazine-1-carbonyl]-N-prop-2-ynylbenzenesulfonamide Traditional Name: 4-[4-(1-phenyltetrazol-5-yl)piperazine-1-carbonyl]-N-propargyl-benzenesulfonamide Formula: C21H21N7O3S MolecularWeight: 451.50154

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C21H21N7O3S/c1-2-12-22-32(30,31)19-10-8-17(9-11-19)20(29)26-13-15-27(16-14-26)21-23-24-25-28(21)18-6-4-3-5-7-18/h1,3-11,22H,12-16H2