methyl (2R,5S)-7-methylsulfanyl-4-oxidanylidene-2-(phenylmethyl)-5-[(triphenylmethyl)amino]heptanoate

Systemtic Name: methyl (2R,5S)-7-methylsulfanyl-4-oxidanylidene-2-(phenylmethyl)-5-[(triphenylmethyl)amino]heptanoate Openeye Name: methyl (2R,5S)-2-benzyl-7-methylsulfanyl-4-oxo-5-(tritylamino)heptanoate CAS Name: (2R,5S)-7-(methylthio)-4-oxo-2-(phenylmethyl)-5-[(triphenylmethyl)amino]heptanoic acid methyl ester IUPAC Name: methyl (2R,5S)-2-benzyl-7-methylsulfanyl-4-oxo-5-(tritylamino)heptanoate Traditional Name: (2R,5S)-2-benzyl-4-keto-7-(methylthio)-5-(tritylamino)enanthic acid methyl ester Formula: C35H37NO3S MolecularWeight: 551.73818

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)CC(=O)C(CCSC)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)CC(=O)[C@H](CCSC)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C35H37NO3S/c1-39-34(38)28(25-27-15-7-3-8-16-27)26-33(37)32(23-24-40-2)36-35(29-17-9-4-10-18-29,30-19-11-5-12-20-30)31-21-13-6-14-22-31/h3-22,28,32,36H,23-26H2,1-2H3/t28-,32+/m1/s1