N,N-diethyl-N'-[(4-methylphenyl)sulfonylmethyl]benzotriazole-1-carboximidamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=NCS(=O)(=O)C1=CC=C(C=C1)C)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CCN(CC)/C(=N\CS(=O)(=O)C1=CC=C(C=C1)C)/N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C19H23N5O2S/c1-4-23(5-2)19(24-18-9-7-6-8-17(18)21-22-24)20-14-27(25,26)16-12-10-15(3)11-13-16/h6-13H,4-5,14H2,1-3H3/b20-19+