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

Systemtic Name: methyl 2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C18H15N3O3S2 MolecularWeight: 385.46

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC3=NC4=C(S3)C=C(C=C4)C(=O)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC3=NC4=C(S3)C=C(C=C4)C(=O)OC

InChI

InChI=1S/C18H15N3O3S2/c1-3-24-11-5-7-13-15(9-11)26-18(20-13)21-17-19-12-6-4-10(16(22)23-2)8-14(12)25-17/h4-9H,3H2,1-2H3,(H,19,20,21)