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

Systemtic Name: 3-chloranyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(2-morpholino-1,3-benzothiazol-6-yl)benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(2-morpholino-1,3-benzothiazol-6-yl)benzothiophene-2-carboxamide Formula: C20H16ClN3O2S2 MolecularWeight: 429.94294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16ClN3O2S2/c21-17-13-3-1-2-4-15(13)27-18(17)19(25)22-12-5-6-14-16(11-12)28-20(23-14)24-7-9-26-10-8-24/h1-6,11H,7-10H2,(H,22,25)