2-(benzotriazol-1-yl)-N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]ethanesulfonamide

Systemtic Name: 2-(benzotriazol-1-yl)-N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]ethanesulfonamide Openeye Name: 2-(benzotriazol-1-yl)-N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]ethanesulfonamide CAS Name: 2-(1-benzotriazolyl)-N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]ethanesulfonamide IUPAC Name: 2-(benzotriazol-1-yl)-N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]ethanesulfonamide Traditional Name: 2-(benzotriazol-1-yl)-N-[1-(4-mesylphenyl)ethyl]-N-methyl-ethanesulfonamide Formula: C18H22N4O4S2 MolecularWeight: 422.52168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)N(C)S(=O)(=O)CCN2C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)N(C)S(=O)(=O)CCN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C18H22N4O4S2/c1-14(15-8-10-16(11-9-15)27(3,23)24)21(2)28(25,26)13-12-22-18-7-5-4-6-17(18)19-20-22/h4-11,14H,12-13H2,1-3H3