N-(3-methylphenyl)-4-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]sulfanyl-butanamide

Systemtic Name: N-(3-methylphenyl)-4-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]sulfanyl-butanamide Openeye Name: N-(m-tolyl)-4-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl-butanamide CAS Name: N-(3-methylphenyl)-4-[[2-oxo-2-(2,4,6-trimethylanilino)ethyl]thio]butanamide IUPAC Name: N-(3-methylphenyl)-4-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanylbutanamide Traditional Name: 4-[(2-keto-2-mesidino-ethyl)thio]-N-(m-tolyl)butyramide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CCCSCC(=O)NC2=C(C=C(C=C2C)C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CCCSCC(=O)NC2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C22H28N2O2S/c1-15-7-5-8-19(13-15)23-20(25)9-6-10-27-14-21(26)24-22-17(3)11-16(2)12-18(22)4/h5,7-8,11-13H,6,9-10,14H2,1-4H3,(H,23,25)(H,24,26)