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

Systemtic Name: N-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-keto-propyl]thiophene-3-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=CSC=C3)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CCNC(=O)C3=CSC=C3)OC1

InChI

InChI=1S/C17H18N2O4S/c20-16(4-6-18-17(21)12-5-9-24-11-12)19-13-2-3-14-15(10-13)23-8-1-7-22-14/h2-3,5,9-11H,1,4,6-8H2,(H,18,21)(H,19,20)