N-butyl-N-[(4-dimethylaminophenyl)methyl]-3-methoxy-4-(1,2,3,4-tetrazol-1-yl)benzenesulfonamide

Systemtic Name: N-butyl-N-[(4-dimethylaminophenyl)methyl]-3-methoxy-4-(1,2,3,4-tetrazol-1-yl)benzenesulfonamide Openeye Name: N-butyl-N-[(4-dimethylaminophenyl)methyl]-3-methoxy-4-(tetrazol-1-yl)benzenesulfonamide CAS Name: N-butyl-N-[(4-dimethylaminophenyl)methyl]-3-methoxy-4-(1-tetrazolyl)benzenesulfonamide IUPAC Name: N-butyl-N-[(4-dimethylaminophenyl)methyl]-3-methoxy-4-(tetrazol-1-yl)benzenesulfonamide Traditional Name: N-butyl-N-[4-(dimethylamino)benzyl]-3-methoxy-4-(tetrazol-1-yl)benzenesulfonamide Formula: C21H28N6O3S MolecularWeight: 444.55042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=C(C=C1)N(C)C)S(=O)(=O)C2=CC(=C(C=C2)N3C=NN=N3)OC

Isomeric SMILES

CCCCN(CC1=CC=C(C=C1)N(C)C)S(=O)(=O)C2=CC(=C(C=C2)N3C=NN=N3)OC

InChI

InChI=1S/C21H28N6O3S/c1-5-6-13-26(15-17-7-9-18(10-8-17)25(2)3)31(28,29)19-11-12-20(21(14-19)30-4)27-16-22-23-24-27/h7-12,14,16H,5-6,13,15H2,1-4H3