N-[4-[2-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]pentanamide

Systemtic Name: N-[4-[2-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]pentanamide Openeye Name: N-[4-[2-(5-chloro-2,4-dimethoxy-anilino)-2-oxo-ethyl]sulfanylphenyl]pentanamide CAS Name: N-[4-[[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]thio]phenyl]pentanamide IUPAC Name: N-[4-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]sulfanylphenyl]pentanamide Traditional Name: N-[4-[[2-(5-chloro-2,4-dimethoxy-anilino)-2-keto-ethyl]thio]phenyl]valeramide Formula: C21H25ClN2O4S MolecularWeight: 436.9522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=CC(=C(C=C2OC)OC)Cl

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=CC(=C(C=C2OC)OC)Cl

InChI

InChI=1S/C21H25ClN2O4S/c1-4-5-6-20(25)23-14-7-9-15(10-8-14)29-13-21(26)24-17-11-16(22)18(27-2)12-19(17)28-3/h7-12H,4-6,13H2,1-3H3,(H,23,25)(H,24,26)