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

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(3-methoxyanilino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[2-(3-methoxyanilino)-2-oxoethyl]thio]benzamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(3-methoxyanilino)-2-oxoethyl]sulfanylbenzamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[2-keto-2-(m-anisidino)ethyl]thio]benzamide Formula: C25H24N2O5S MolecularWeight: 464.53346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CSC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CSC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C25H24N2O5S/c1-30-19-7-4-6-17(14-19)26-24(28)16-33-23-9-3-2-8-20(23)25(29)27-18-10-11-21-22(15-18)32-13-5-12-31-21/h2-4,6-11,14-15H,5,12-13,16H2,1H3,(H,26,28)(H,27,29)