methyl 2-[[3-sulfanyl-2-[(triphenylmethyl)amino]propanoyl]amino]ethanoate

Systemtic Name: methyl 2-[[3-sulfanyl-2-[(triphenylmethyl)amino]propanoyl]amino]ethanoate Openeye Name: methyl 2-[[3-sulfanyl-2-(tritylamino)propanoyl]amino]acetate CAS Name: 2-[[3-mercapto-1-oxo-2-[(triphenylmethyl)amino]propyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[3-sulfanyl-2-(tritylamino)propanoyl]amino]acetate Traditional Name: 2-[[3-mercapto-2-(tritylamino)propanoyl]amino]acetic acid methyl ester Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C(CS)NC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CNC(=O)C(CS)NC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H26N2O3S/c1-30-23(28)17-26-24(29)22(18-31)27-25(19-11-5-2-6-12-19,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,22,27,31H,17-18H2,1H3,(H,26,29)