N-[4-[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]pentanamide

Systemtic Name: N-[4-[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]pentanamide Openeye Name: N-[4-[2-(2,4-dimethoxyanilino)-2-oxo-ethyl]sulfanylphenyl]pentanamide CAS Name: N-[4-[[2-(2,4-dimethoxyanilino)-2-oxoethyl]thio]phenyl]pentanamide IUPAC Name: N-[4-[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanylphenyl]pentanamide Traditional Name: N-[4-[[2-(2,4-dimethoxyanilino)-2-keto-ethyl]thio]phenyl]valeramide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=C(C=C(C=C2)OC)OC

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=C(C=C(C=C2)OC)OC

InChI

InChI=1S/C21H26N2O4S/c1-4-5-6-20(24)22-15-7-10-17(11-8-15)28-14-21(25)23-18-12-9-16(26-2)13-19(18)27-3/h7-13H,4-6,14H2,1-3H3,(H,22,24)(H,23,25)