N-(2-cyanoethyl)-N-(3-ethoxypropyl)-3-methoxy-4-(1,2,3,4-tetrazol-1-yl)benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-N-(3-ethoxypropyl)-3-methoxy-4-(1,2,3,4-tetrazol-1-yl)benzenesulfonamide Openeye Name: N-(2-cyanoethyl)-N-(3-ethoxypropyl)-3-methoxy-4-(tetrazol-1-yl)benzenesulfonamide CAS Name: N-(2-cyanoethyl)-N-(3-ethoxypropyl)-3-methoxy-4-(1-tetrazolyl)benzenesulfonamide IUPAC Name: N-(2-cyanoethyl)-N-(3-ethoxypropyl)-3-methoxy-4-(tetrazol-1-yl)benzenesulfonamide Traditional Name: N-(2-cyanoethyl)-N-(3-ethoxypropyl)-3-methoxy-4-(tetrazol-1-yl)benzenesulfonamide Formula: C16H22N6O4S MolecularWeight: 394.44868

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN(CCC#N)S(=O)(=O)C1=CC(=C(C=C1)N2C=NN=N2)OC

Isomeric SMILES

CCOCCCN(CCC#N)S(=O)(=O)C1=CC(=C(C=C1)N2C=NN=N2)OC

InChI

InChI=1S/C16H22N6O4S/c1-3-26-11-5-10-21(9-4-8-17)27(23,24)14-6-7-15(16(12-14)25-2)22-13-18-19-20-22/h6-7,12-13H,3-5,9-11H2,1-2H3