(2-morpholin-4-yl-1,3-benzothiazol-6-yl) 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (2-morpholin-4-yl-1,3-benzothiazol-6-yl) 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: (2-morpholino-1,3-benzothiazol-6-yl) 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid [2-(4-morpholinyl)-1,3-benzothiazol-6-yl] ester IUPAC Name: (2-morpholin-4-yl-1,3-benzothiazol-6-yl) 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid (2-morpholino-1,3-benzothiazol-6-yl) ester Formula: C20H15ClN2O3S2 MolecularWeight: 430.9277

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)OC(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)OC(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C20H15ClN2O3S2/c21-17-13-3-1-2-4-15(13)27-18(17)19(24)26-12-5-6-14-16(11-12)28-20(22-14)23-7-9-25-10-8-23/h1-6,11H,7-10H2