methyl (2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propyl]carbamothioylamino]propanoate

Systemtic Name: methyl (2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propyl]carbamothioylamino]propanoate Openeye Name: methyl (2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propyl]carbamothioylamino]propanoate CAS Name: (2S)-2-[[[[(2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-phenylpropyl]amino]-sulfanylidenemethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenylpropyl]carbamothioylamino]propanoate Traditional Name: (2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propyl]thiocarbamoylamino]propionic acid methyl ester Formula: C29H31N3O4S MolecularWeight: 517.63914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=S)NCC(CC1=CC=CC=C1)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

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

InChI

InChI=1S/C29H31N3O4S/c1-19(27(33)35-2)31-28(37)30-17-21(16-20-10-4-3-5-11-20)32-29(34)36-18-26-24-14-8-6-12-22(24)23-13-7-9-15-25(23)26/h3-15,19,21,26H,16-18H2,1-2H3,(H,32,34)(H2,30,31,37)/t19-,21-/m0/s1