methyl 2-[(5,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[(5,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[(5,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(5,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(5,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(5,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C18H15N3O4S2 MolecularWeight: 401.4594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(S2)NC3=NC4=C(S3)C=C(C=C4)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(S2)NC3=NC4=C(S3)C=C(C=C4)C(=O)OC)OC

InChI

InChI=1S/C18H15N3O4S2/c1-23-12-7-11-15(8-13(12)24-2)27-18(20-11)21-17-19-10-5-4-9(16(22)25-3)6-14(10)26-17/h4-8H,1-3H3,(H,19,20,21)