N-[3-[1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]butanamide

Systemtic Name: N-[3-[1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]butanamide Openeye Name: N-[3-[2-(4-ethoxyanilino)-1-methyl-2-oxo-ethyl]sulfanylphenyl]butanamide CAS Name: N-[3-[[1-(4-ethoxyanilino)-1-oxopropan-2-yl]thio]phenyl]butanamide IUPAC Name: N-[3-[1-(4-ethoxyanilino)-1-oxopropan-2-yl]sulfanylphenyl]butanamide Traditional Name: N-[3-[[2-keto-1-methyl-2-(p-phenetidino)ethyl]thio]phenyl]butyramide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=CC=C1)SC(C)C(=O)NC2=CC=C(C=C2)OCC

Isomeric SMILES

CCCC(=O)NC1=CC(=CC=C1)SC(C)C(=O)NC2=CC=C(C=C2)OCC

InChI

InChI=1S/C21H26N2O3S/c1-4-7-20(24)22-17-8-6-9-19(14-17)27-15(3)21(25)23-16-10-12-18(13-11-16)26-5-2/h6,8-15H,4-5,7H2,1-3H3,(H,22,24)(H,23,25)