methyl (2R)-2-(3-methylbut-2-enoylamino)-3-(triphenylmethyl)sulfanyl-propanoate

Systemtic Name: methyl (2R)-2-(3-methylbut-2-enoylamino)-3-(triphenylmethyl)sulfanyl-propanoate Openeye Name: methyl (2R)-2-(3-methylbut-2-enoylamino)-3-tritylsulfanyl-propanoate CAS Name: (2R)-2-[(3-methyl-1-oxobut-2-enyl)amino]-3-[(triphenylmethyl)thio]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-(3-methylbut-2-enoylamino)-3-tritylsulfanylpropanoate Traditional Name: (2R)-2-(3-methylbut-2-enoylamino)-3-(tritylthio)propionic acid methyl ester Formula: C28H29NO3S MolecularWeight: 459.59976

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)C

Isomeric SMILES

CC(=CC(=O)N[C@@H](CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)C

InChI

InChI=1S/C28H29NO3S/c1-21(2)19-26(30)29-25(27(31)32-3)20-33-28(22-13-7-4-8-14-22,23-15-9-5-10-16-23)24-17-11-6-12-18-24/h4-19,25H,20H2,1-3H3,(H,29,30)/t25-/m0/s1