9H-fluoren-9-ylmethyl N-[(2S)-1-(1,3-benzothiazol-2-ylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: 9H-fluoren-9-ylmethyl N-[(2S)-1-(1,3-benzothiazol-2-ylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: 9H-fluoren-9-ylmethyl N-[(1S)-2-(1,3-benzothiazol-2-ylamino)-1-benzyl-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-(1,3-benzothiazol-2-ylamino)-1-oxo-3-phenylpropan-2-yl]carbamic acid 9H-fluoren-9-ylmethyl ester IUPAC Name: 9H-fluoren-9-ylmethyl N-[(2S)-1-(1,3-benzothiazol-2-ylamino)-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1S)-2-(1,3-benzothiazol-2-ylamino)-1-benzyl-2-keto-ethyl]carbamic acid 9H-fluoren-9-ylmethyl ester Formula: C31H25N3O3S MolecularWeight: 519.6135

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=NC3=CC=CC=C3S2)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NC2=NC3=CC=CC=C3S2)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46

InChI

InChI=1S/C31H25N3O3S/c35-29(34-30-32-26-16-8-9-17-28(26)38-30)27(18-20-10-2-1-3-11-20)33-31(36)37-19-25-23-14-6-4-12-21(23)22-13-5-7-15-24(22)25/h1-17,25,27H,18-19H2,(H,33,36)(H,32,34,35)/t27-/m0/s1