ethyl 2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-sulfanyl-propanoate

Systemtic Name: ethyl 2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-sulfanyl-propanoate Openeye Name: ethyl 2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-sulfanyl-propanoate CAS Name: 2-[[(2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-1-oxo-3-phenylpropyl]amino]-3-mercaptopropanoic acid ethyl ester IUPAC Name: ethyl 2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenylpropanoyl]amino]-3-sulfanylpropanoate Traditional Name: 2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-mercapto-propionic acid ethyl ester Formula: C29H30N2O5S MolecularWeight: 518.6239

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CS)NC(=O)C(CC1=CC=CC=C1)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

CCOC(=O)C(CS)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C29H30N2O5S/c1-2-35-28(33)26(18-37)30-27(32)25(16-19-10-4-3-5-11-19)31-29(34)36-17-24-22-14-8-6-12-20(22)21-13-7-9-15-23(21)24/h3-15,24-26,37H,2,16-18H2,1H3,(H,30,32)(H,31,34)/t25-,26?/m0/s1