N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1,3-benzothiazole-6-carboxamide Openeye Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1,3-benzothiazole-6-carboxamide CAS Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1,3-benzothiazole-6-carboxamide Traditional Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1,3-benzothiazole-6-carboxamide Formula: C18H15ClN2O3S MolecularWeight: 374.8413

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CNC(=O)C3=CC4=C(C=C3)N=CS4)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CNC(=O)C3=CC4=C(C=C3)N=CS4)Cl)OC1

InChI

InChI=1S/C18H15ClN2O3S/c19-13-6-11(7-15-17(13)24-5-1-4-23-15)9-20-18(22)12-2-3-14-16(8-12)25-10-21-14/h2-3,6-8,10H,1,4-5,9H2,(H,20,22)