1-(3-methoxyphenyl)-4-[3-methyl-4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonyl-piperazine

Systemtic Name: 1-(3-methoxyphenyl)-4-[3-methyl-4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonyl-piperazine Openeye Name: 1-(3-methoxyphenyl)-4-[3-methyl-4-(tetrazol-1-yl)phenyl]sulfonyl-piperazine CAS Name: 1-(3-methoxyphenyl)-4-[3-methyl-4-(1-tetrazolyl)phenyl]sulfonylpiperazine IUPAC Name: 1-(3-methoxyphenyl)-4-[3-methyl-4-(tetrazol-1-yl)phenyl]sulfonylpiperazine Traditional Name: 1-(3-methoxyphenyl)-4-[3-methyl-4-(tetrazol-1-yl)phenyl]sulfonyl-piperazine Formula: C19H22N6O3S MolecularWeight: 414.48138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=CC=C3)OC)N4C=NN=N4

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=CC=C3)OC)N4C=NN=N4

InChI

InChI=1S/C19H22N6O3S/c1-15-12-18(6-7-19(15)25-14-20-21-22-25)29(26,27)24-10-8-23(9-11-24)16-4-3-5-17(13-16)28-2/h3-7,12-14H,8-11H2,1-2H3