N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[2-oxo-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propanamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[2-keto-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propionamide Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CCN3C(=O)OC(=N3)C4=CC=CS4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CCN3C(=O)OC(=N3)C4=CC=CS4)OC1

InChI

InChI=1S/C18H17N3O5S/c22-16(19-12-4-5-13-14(11-12)25-9-2-8-24-13)6-7-21-18(23)26-17(20-21)15-3-1-10-27-15/h1,3-5,10-11H,2,6-9H2,(H,19,22)