phenyl N-[3-[(6-methylsulfonyl-4-oxidanylidene-1,2,3-benzotriazin-3-yl)sulfonyl]phenyl]carbamate

Systemtic Name: phenyl N-[3-[(6-methylsulfonyl-4-oxidanylidene-1,2,3-benzotriazin-3-yl)sulfonyl]phenyl]carbamate Openeye Name: phenyl N-[3-[(6-methylsulfonyl-4-oxo-1,2,3-benzotriazin-3-yl)sulfonyl]phenyl]carbamate CAS Name: N-[3-[(6-methylsulfonyl-4-oxo-1,2,3-benzotriazin-3-yl)sulfonyl]phenyl]carbamic acid phenyl ester IUPAC Name: phenyl N-[3-[(6-methylsulfonyl-4-oxo-1,2,3-benzotriazin-3-yl)sulfonyl]phenyl]carbamate Traditional Name: N-[3-[(4-keto-6-mesyl-1,2,3-benzotriazin-3-yl)sulfonyl]phenyl]carbamic acid phenyl ester Formula: C21H16N4O7S2 MolecularWeight: 500.50434

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=NN(C2=O)S(=O)(=O)C3=CC=CC(=C3)NC(=O)OC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=NN(C2=O)S(=O)(=O)C3=CC=CC(=C3)NC(=O)OC4=CC=CC=C4

InChI

InChI=1S/C21H16N4O7S2/c1-33(28,29)16-10-11-19-18(13-16)20(26)25(24-23-19)34(30,31)17-9-5-6-14(12-17)22-21(27)32-15-7-3-2-4-8-15/h2-13H,1H3,(H,22,27)