2-(benzotriazol-1-ylmethyl)-1-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonyl-guanidine

Systemtic Name: 2-(benzotriazol-1-ylmethyl)-1-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonyl-guanidine Openeye Name: 2-(benzotriazol-1-ylmethyl)-1-(4-methoxyphenyl)-3-(p-tolylsulfonyl)guanidine CAS Name: 2-(1-benzotriazolylmethyl)-1-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonylguanidine IUPAC Name: 2-(benzotriazol-1-ylmethyl)-1-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonylguanidine Traditional Name: 2-(benzotriazol-1-ylmethyl)-1-(4-methoxyphenyl)-3-tosyl-guanidine Formula: C22H22N6O3S MolecularWeight: 450.51348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=NCN2C3=CC=CC=C3N=N2)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N/C(=N/CN2C3=CC=CC=C3N=N2)/NC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H22N6O3S/c1-16-7-13-19(14-8-16)32(29,30)26-22(24-17-9-11-18(31-2)12-10-17)23-15-28-21-6-4-3-5-20(21)25-27-28/h3-14H,15H2,1-2H3,(H2,23,24,26)