methyl 2-(2,2-diphenylethylcarbamoylamino)-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-(2,2-diphenylethylcarbamoylamino)-4-methylsulfanyl-butanoate Openeye Name: methyl 2-(2,2-diphenylethylcarbamoylamino)-4-methylsulfanyl-butanoate CAS Name: 2-[[(2,2-diphenylethylamino)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-(2,2-diphenylethylcarbamoylamino)-4-methylsulfanylbutanoate Traditional Name: 2-(2,2-diphenylethylcarbamoylamino)-4-(methylthio)butyric acid methyl ester Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)NCC(C1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)NCC(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C21H26N2O3S/c1-26-20(24)19(13-14-27-2)23-21(25)22-15-18(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,18-19H,13-15H2,1-2H3,(H2,22,23,25)