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

Systemtic Name: N-[3-[1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]butanamide Openeye Name: N-[3-[2-(4-acetamidoanilino)-1-methyl-2-oxo-ethyl]sulfanylphenyl]butanamide CAS Name: N-[3-[[1-(4-acetamidoanilino)-1-oxopropan-2-yl]thio]phenyl]butanamide IUPAC Name: N-[3-[1-(4-acetamidoanilino)-1-oxopropan-2-yl]sulfanylphenyl]butanamide Traditional Name: N-[3-[[2-(4-acetamidoanilino)-2-keto-1-methyl-ethyl]thio]phenyl]butyramide Formula: C21H25N3O3S MolecularWeight: 399.5065

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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)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O3S/c1-4-6-20(26)23-18-7-5-8-19(13-18)28-14(2)21(27)24-17-11-9-16(10-12-17)22-15(3)25/h5,7-14H,4,6H2,1-3H3,(H,22,25)(H,23,26)(H,24,27)