9H-fluoren-9-ylmethyl N-[(1S)-1-isocyanato-2-(phenylmethylsulfanyl)ethyl]carbamate

Systemtic Name: 9H-fluoren-9-ylmethyl N-[(1S)-1-isocyanato-2-(phenylmethylsulfanyl)ethyl]carbamate Openeye Name: 9H-fluoren-9-ylmethyl N-[(1S)-2-benzylsulfanyl-1-isocyanato-ethyl]carbamate CAS Name: N-[(1S)-1-isocyanato-2-(phenylmethylthio)ethyl]carbamic acid 9H-fluoren-9-ylmethyl ester IUPAC Name: 9H-fluoren-9-ylmethyl N-[(1S)-2-benzylsulfanyl-1-isocyanatoethyl]carbamate Traditional Name: N-[(1S)-2-(benzylthio)-1-isocyanato-ethyl]carbamic acid 9H-fluoren-9-ylmethyl ester Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)N=C=O

Isomeric SMILES

C1=CC=C(C=C1)CSC[C@@H](NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)N=C=O

InChI

InChI=1S/C25H22N2O3S/c28-17-26-24(16-31-15-18-8-2-1-3-9-18)27-25(29)30-14-23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h1-13,23-24H,14-16H2,(H,27,29)/t24-/m1/s1