(2-azanyl-6-methoxy-1,3-benzothiazol-5-yl) 4-methylbenzenesulfonate

Systemtic Name: (2-azanyl-6-methoxy-1,3-benzothiazol-5-yl) 4-methylbenzenesulfonate Openeye Name: (2-amino-6-methoxy-1,3-benzothiazol-5-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-amino-6-methoxy-1,3-benzothiazol-5-yl) ester IUPAC Name: (2-amino-6-methoxy-1,3-benzothiazol-5-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-amino-6-methoxy-1,3-benzothiazol-5-yl) ester Formula: C15H14N2O4S2 MolecularWeight: 350.41266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C3C(=C2)N=C(S3)N)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C3C(=C2)N=C(S3)N)OC

InChI

InChI=1S/C15H14N2O4S2/c1-9-3-5-10(6-4-9)23(18,19)21-13-7-11-14(8-12(13)20-2)22-15(16)17-11/h3-8H,1-2H3,(H2,16,17)