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

Systemtic Name: 1-[3-methoxy-4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonyl-4-phenyl-piperazine Openeye Name: 1-[3-methoxy-4-(tetrazol-1-yl)phenyl]sulfonyl-4-phenyl-piperazine CAS Name: 1-[3-methoxy-4-(1-tetrazolyl)phenyl]sulfonyl-4-phenylpiperazine IUPAC Name: 1-[3-methoxy-4-(tetrazol-1-yl)phenyl]sulfonyl-4-phenylpiperazine Traditional Name: 1-[3-methoxy-4-(tetrazol-1-yl)phenyl]sulfonyl-4-phenyl-piperazine Formula: C18H20N6O3S MolecularWeight: 400.4548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3)N4C=NN=N4

Isomeric SMILES

COC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3)N4C=NN=N4

InChI

InChI=1S/C18H20N6O3S/c1-27-18-13-16(7-8-17(18)24-14-19-20-21-24)28(25,26)23-11-9-22(10-12-23)15-5-3-2-4-6-15/h2-8,13-14H,9-12H2,1H3