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N,N'-bis(4-methoxy-1,3-benzothiazol-2-yl)methanedisulfonamide

N,N'-bis(4-methoxy-1,3-benzothiazol-2-yl)methanedisulfonamide

Systemtic Name:N,N'-bis(4-methoxy-1,3-benzothiazol-2-yl)methanedisulfonamide
Openeye Name:N,N'-bis(4-methoxy-1,3-benzothiazol-2-yl)methanedisulfonamide
CAS Name:N,N'-bis(4-methoxy-1,3-benzothiazol-2-yl)methanedisulfonamide
IUPAC Name:N,N'-bis(4-methoxy-1,3-benzothiazol-2-yl)methanedisulfonamide
Traditional Name:N,N'-bis(4-methoxy-1,3-benzothiazol-2-yl)methanedisulfonamide
Formula: C17H16N4O6S4
MolecularWeight: 500.59214
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC=C1)SC(=N2)NS(=O)(=O)CS(=O)(=O)NC3=NC4=C(C=CC=C4S3)OC


Isomeric SMILES

COC1=C2C(=CC=C1)SC(=N2)NS(=O)(=O)CS(=O)(=O)NC3=NC4=C(C=CC=C4S3)OC


InChI

InChI=1S/C17H16N4O6S4/c1-26-10-5-3-7-12-14(10)18-16(28-12)20-30(22,23)9-31(24,25)21-17-19-15-11(27-2)6-4-8-13(15)29-17/h3-8H,9H2,1-2H3,(H,18,20)(H,19,21)


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