N-(3-methylbutyl)-N-(4-methylphenyl)sulfonyl-benzotriazole-1-carboxamide

Systemtic Name: N-(3-methylbutyl)-N-(4-methylphenyl)sulfonyl-benzotriazole-1-carboxamide Openeye Name: N-isopentyl-N-(p-tolylsulfonyl)benzotriazole-1-carboxamide CAS Name: N-(3-methylbutyl)-N-(4-methylphenyl)sulfonyl-1-benzotriazolecarboxamide IUPAC Name: N-(3-methylbutyl)-N-(4-methylphenyl)sulfonylbenzotriazole-1-carboxamide Traditional Name: N-isoamyl-N-tosyl-benzotriazole-1-carboxamide Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(C)C)C(=O)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(C)C)C(=O)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C19H22N4O3S/c1-14(2)12-13-22(27(25,26)16-10-8-15(3)9-11-16)19(24)23-18-7-5-4-6-17(18)20-21-23/h4-11,14H,12-13H2,1-3H3