N'-[(4-methylphenyl)sulfonylmethyl]-N-(2-methylpropyl)benzotriazole-1-carboximidamide

Systemtic Name: N'-[(4-methylphenyl)sulfonylmethyl]-N-(2-methylpropyl)benzotriazole-1-carboximidamide Openeye Name: N-isobutyl-N'-(p-tolylsulfonylmethyl)benzotriazole-1-carboxamidine CAS Name: N'-[(4-methylphenyl)sulfonylmethyl]-N-(2-methylpropyl)-1-benzotriazolecarboximidamide IUPAC Name: N'-[(4-methylphenyl)sulfonylmethyl]-N-(2-methylpropyl)benzotriazole-1-carboximidamide Traditional Name: N-isobutyl-N'-(tosylmethyl)benzotriazole-1-carboxamidine Formula: C19H23N5O2S MolecularWeight: 385.48322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CN=C(NCC(C)C)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C/N=C(\NCC(C)C)/N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C19H23N5O2S/c1-14(2)12-20-19(24-18-7-5-4-6-17(18)22-23-24)21-13-27(25,26)16-10-8-15(3)9-11-16/h4-11,14H,12-13H2,1-3H3,(H,20,21)