N-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-oxidanylidene-propyl]thiophene-2-carboxamide

Systemtic Name: N-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-oxidanylidene-propyl]thiophene-2-carboxamide Openeye Name: N-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-oxo-propyl]thiophene-2-carboxamide CAS Name: N-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-oxopropyl]-2-thiophenecarboxamide IUPAC Name: N-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-oxopropyl]thiophene-2-carboxamide Traditional Name: N-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-keto-propyl]thiophene-2-carboxamide Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CCNC(=O)C3=CC=CS3)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CCNC(=O)C3=CC=CS3)OC1

InChI

InChI=1S/C17H18N2O4S/c20-16(6-7-18-17(21)15-3-1-10-24-15)19-12-4-5-13-14(11-12)23-9-2-8-22-13/h1,3-5,10-11H,2,6-9H2,(H,18,21)(H,19,20)