N-[(3,4-dimethoxyphenyl)methyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-1,1-dioxo-1,2-benzothiazol-3-amine CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-1,1-dioxo-1,2-benzothiazol-3-amine IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-1,1-dioxo-1,2-benzothiazol-3-amine Traditional Name: (1,1-diketo-1,2-benzothiazol-3-yl)-veratryl-amine Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NS(=O)(=O)C3=CC=CC=C32)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NS(=O)(=O)C3=CC=CC=C32)OC

InChI

InChI=1S/C16H16N2O4S/c1-21-13-8-7-11(9-14(13)22-2)10-17-16-12-5-3-4-6-15(12)23(19,20)18-16/h3-9H,10H2,1-2H3,(H,17,18)