N-(2,5-dimethoxyphenyl)-3-[3-[(2,5-dimethoxyphenyl)amino]-3-oxidanylidene-propyl]sulfanyl-propanamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-3-[3-[(2,5-dimethoxyphenyl)amino]-3-oxidanylidene-propyl]sulfanyl-propanamide Openeye Name: 3-[3-(2,5-dimethoxyanilino)-3-oxo-propyl]sulfanyl-N-(2,5-dimethoxyphenyl)propanamide CAS Name: 3-[[3-(2,5-dimethoxyanilino)-3-oxopropyl]thio]-N-(2,5-dimethoxyphenyl)propanamide IUPAC Name: 3-[3-(2,5-dimethoxyanilino)-3-oxopropyl]sulfanyl-N-(2,5-dimethoxyphenyl)propanamide Traditional Name: 3-[[3-(2,5-dimethoxyanilino)-3-keto-propyl]thio]-N-(2,5-dimethoxyphenyl)propionamide Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)CCSCCC(=O)NC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)CCSCCC(=O)NC2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C22H28N2O6S/c1-27-15-5-7-19(29-3)17(13-15)23-21(25)9-11-31-12-10-22(26)24-18-14-16(28-2)6-8-20(18)30-4/h5-8,13-14H,9-12H2,1-4H3,(H,23,25)(H,24,26)