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

Systemtic Name: methyl 3-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propyl]carbamothioylamino]propanoate Openeye Name: methyl 3-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propyl]carbamothioylamino]propanoate CAS Name: 3-[[[[(2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]propyl]amino]-sulfanylidenemethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propyl]carbamothioylamino]propanoate Traditional Name: 3-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propyl]thiocarbamoylamino]propionic acid methyl ester Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=S)NCCC(=O)OC)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

Isomeric SMILES

C[C@@H](CNC(=S)NCCC(=O)OC)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

InChI

InChI=1S/C23H27N3O4S/c1-15(13-25-22(31)24-12-11-21(27)29-2)26-23(28)30-14-20-18-9-5-3-7-16(18)17-8-4-6-10-19(17)20/h3-10,15,20H,11-14H2,1-2H3,(H,26,28)(H2,24,25,31)/t15-/m0/s1