N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]benzamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanylbenzamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[2-(2-furfurylamino)-2-keto-ethyl]thio]benzamide Formula: C23H22N2O5S MolecularWeight: 438.49618

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3SCC(=O)NCC4=CC=CO4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3SCC(=O)NCC4=CC=CO4)OC1

InChI

InChI=1S/C23H22N2O5S/c26-22(24-14-17-5-3-10-28-17)15-31-21-7-2-1-6-18(21)23(27)25-16-8-9-19-20(13-16)30-12-4-11-29-19/h1-3,5-10,13H,4,11-12,14-15H2,(H,24,26)(H,25,27)