N-[2-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylamino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylamino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylamino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylamino]-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylamino]-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-[2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylamino]-2-keto-ethyl]thiophene-2-carboxamide Formula: C17H17ClN2O4S MolecularWeight: 380.84588

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CNC(=O)CNC(=O)C3=CC=CS3)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CNC(=O)CNC(=O)C3=CC=CS3)Cl)OC1

InChI

InChI=1S/C17H17ClN2O4S/c18-12-7-11(8-13-16(12)24-5-2-4-23-13)9-19-15(21)10-20-17(22)14-3-1-6-25-14/h1,3,6-8H,2,4-5,9-10H2,(H,19,21)(H,20,22)