N-[3-[2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-3,3-dimethyl-butanamide

Systemtic Name: N-[3-[2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-3,3-dimethyl-butanamide Openeye Name: N-[3-[2-(3-chloro-4-methoxy-anilino)-2-oxo-ethyl]sulfanylphenyl]-3,3-dimethyl-butanamide CAS Name: N-[3-[[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]thio]phenyl]-3,3-dimethylbutanamide IUPAC Name: N-[3-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]sulfanylphenyl]-3,3-dimethylbutanamide Traditional Name: N-[3-[[2-(3-chloro-4-methoxy-anilino)-2-keto-ethyl]thio]phenyl]-3,3-dimethyl-butyramide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN2O3S/c1-21(2,3)12-19(25)23-14-6-5-7-16(10-14)28-13-20(26)24-15-8-9-18(27-4)17(22)11-15/h5-11H,12-13H2,1-4H3,(H,23,25)(H,24,26)