3-chloranyl-N-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]benzamide

Systemtic Name: 3-chloranyl-N-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]benzamide Openeye Name: 3-chloro-N-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]benzamide CAS Name: 3-chloro-N-[3-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-1-phenylethyl]thio]phenyl]benzamide IUPAC Name: 3-chloro-N-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-1-phenylethyl]sulfanylphenyl]benzamide Traditional Name: 3-chloro-N-[3-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-keto-1-phenyl-ethyl]thio]phenyl]benzamide Formula: C29H23ClN2O4S MolecularWeight: 531.02192

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC(=C4)NC(=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC(=C4)NC(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C29H23ClN2O4S/c30-21-9-4-8-20(16-21)28(33)31-22-10-5-11-24(17-22)37-27(19-6-2-1-3-7-19)29(34)32-23-12-13-25-26(18-23)36-15-14-35-25/h1-13,16-18,27H,14-15H2,(H,31,33)(H,32,34)