methyl 2-[2-azanylpropanoyl-(triphenylmethyl)sulfanyl-amino]-3-methyl-butanoate

Systemtic Name: methyl 2-[2-azanylpropanoyl-(triphenylmethyl)sulfanyl-amino]-3-methyl-butanoate Openeye Name: methyl 2-[2-aminopropanoyl(tritylsulfanyl)amino]-3-methyl-butanoate CAS Name: 2-[(2-amino-1-oxopropyl)-[(triphenylmethyl)thio]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[2-aminopropanoyl(tritylsulfanyl)amino]-3-methylbutanoate Traditional Name: 2-[alanyl-(tritylthio)amino]-3-methyl-butyric acid methyl ester Formula: C28H32N2O3S MolecularWeight: 476.63028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)N(C(=O)C(C)N)SC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)OC)N(C(=O)C(C)N)SC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C28H32N2O3S/c1-20(2)25(27(32)33-4)30(26(31)21(3)29)34-28(22-14-8-5-9-15-22,23-16-10-6-11-17-23)24-18-12-7-13-19-24/h5-21,25H,29H2,1-4H3