3-methoxy-N-phenethyl-4-(1,2,3,4-tetrazol-1-yl)-N-(thiophen-2-ylmethyl)benzenesulfonamide

Systemtic Name: 3-methoxy-N-phenethyl-4-(1,2,3,4-tetrazol-1-yl)-N-(thiophen-2-ylmethyl)benzenesulfonamide Openeye Name: 3-methoxy-N-phenethyl-4-(tetrazol-1-yl)-N-(2-thienylmethyl)benzenesulfonamide CAS Name: 3-methoxy-N-phenethyl-4-(1-tetrazolyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide IUPAC Name: 3-methoxy-N-phenethyl-4-(tetrazol-1-yl)-N-(thiophen-2-ylmethyl)benzenesulfonamide Traditional Name: 3-methoxy-N-phenethyl-4-(tetrazol-1-yl)-N-(2-thenyl)benzenesulfonamide Formula: C21H21N5O3S2 MolecularWeight: 455.55314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC3=CC=CS3)N4C=NN=N4

Isomeric SMILES

COC1=C(C=CC(=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC3=CC=CS3)N4C=NN=N4

InChI

InChI=1S/C21H21N5O3S2/c1-29-21-14-19(9-10-20(21)26-16-22-23-24-26)31(27,28)25(15-18-8-5-13-30-18)12-11-17-6-3-2-4-7-17/h2-10,13-14,16H,11-12,15H2,1H3