N1-[3-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]-N4,N4-dimethyl-benzene-1,4-disulfonamide

Systemtic Name: N1-[3-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]-N4,N4-dimethyl-benzene-1,4-disulfonamide Openeye Name: N1-[3-(1-cyclopropyltetrazol-5-yl)phenyl]-N4,N4-dimethyl-benzene-1,4-disulfonamide CAS Name: N1-[3-(1-cyclopropyl-5-tetrazolyl)phenyl]-N4,N4-dimethylbenzene-1,4-disulfonamide IUPAC Name: 1-N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]-4-N,4-N-dimethylbenzene-1,4-disulfonamide Traditional Name: N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]-N',N'-dimethyl-benzene-1,4-disulfonamide Formula: C18H20N6O4S2 MolecularWeight: 448.5192

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C3=NN=NN3C4CC4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C3=NN=NN3C4CC4

InChI

InChI=1S/C18H20N6O4S2/c1-23(2)30(27,28)17-10-8-16(9-11-17)29(25,26)20-14-5-3-4-13(12-14)18-19-21-22-24(18)15-6-7-15/h3-5,8-12,15,20H,6-7H2,1-2H3