3-chloranyl-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)benzothiophene-2-carboxamide CAS Name: 3-chloro-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)benzothiophene-2-carboxamide Formula: C20H13ClN2OS2 MolecularWeight: 396.91302

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)N=C(S2)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)N=C(S2)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C20H13ClN2OS2/c21-16-13-7-3-4-8-14(13)25-18(16)19(24)23-20-22-17-12-6-2-1-5-11(12)9-10-15(17)26-20/h1-8H,9-10H2,(H,22,23,24)