N-[3-[(4-methoxyphenyl)methyl]-5-sulfanidyl-1,2,4-triazol-4-yl]-N'-(4-methylphenyl)sulfonyl-carbamimidate

Systemtic Name: N-[3-[(4-methoxyphenyl)methyl]-5-sulfanidyl-1,2,4-triazol-4-yl]-N'-(4-methylphenyl)sulfonyl-carbamimidate Openeye Name: N-[3-[(4-methoxyphenyl)methyl]-5-sulfido-1,2,4-triazol-4-yl]-N'-(p-tolylsulfonyl)carbamimidate CAS Name: N-[3-[(4-methoxyphenyl)methyl]-5-sulfido-1,2,4-triazol-4-yl]-N'-(4-methylphenyl)sulfonylcarbamimidate IUPAC Name: N-[3-[(4-methoxyphenyl)methyl]-5-sulfido-1,2,4-triazol-4-yl]-N'-(4-methylphenyl)sulfonylcarbamimidate Traditional Name: N-(3-p-anisyl-5-sulfido-1,2,4-triazol-4-yl)-N'-tosyl-carbamimidate Formula: C18H17N5O4S2-2 MolecularWeight: 431.48868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C(NN2C(=NN=C2[S-])CC3=CC=C(C=C3)OC)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N=C(NN2C(=NN=C2[S-])CC3=CC=C(C=C3)OC)[O-]

InChI

InChI=1S/C18H19N5O4S2/c1-12-3-9-15(10-4-12)29(25,26)22-17(24)21-23-16(19-20-18(23)28)11-13-5-7-14(27-2)8-6-13/h3-10H,11H2,1-2H3,(H,20,28)(H2,21,22,24)/p-2