methyl 2-[(1-propylcyclohexyl)carbonylamino]-3-(triphenylmethyl)sulfanyl-propanoate

Systemtic Name: methyl 2-[(1-propylcyclohexyl)carbonylamino]-3-(triphenylmethyl)sulfanyl-propanoate Openeye Name: methyl 2-[(1-propylcyclohexanecarbonyl)amino]-3-tritylsulfanyl-propanoate CAS Name: 2-[[oxo-(1-propylcyclohexyl)methyl]amino]-3-[(triphenylmethyl)thio]propanoic acid methyl ester IUPAC Name: methyl 2-[(1-propylcyclohexanecarbonyl)amino]-3-tritylsulfanylpropanoate Traditional Name: 2-[(1-propylcyclohexanecarbonyl)amino]-3-(tritylthio)propionic acid methyl ester Formula: C33H39NO3S MolecularWeight: 529.73266

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCCCC1)C(=O)NC(CSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CCCC1(CCCCC1)C(=O)NC(CSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C33H39NO3S/c1-3-22-32(23-14-7-15-24-32)31(36)34-29(30(35)37-2)25-38-33(26-16-8-4-9-17-26,27-18-10-5-11-19-27)28-20-12-6-13-21-28/h4-6,8-13,16-21,29H,3,7,14-15,22-25H2,1-2H3,(H,34,36)