tert-butyl N-[4-[(1S,2S)-3-azanyl-2-chloranyl-1-phenylmethoxy-propyl]-1,3-thiazol-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-[(1S,2S)-3-azanyl-2-chloranyl-1-phenylmethoxy-propyl]-1,3-thiazol-2-yl]carbamate Openeye Name: tert-butyl N-[4-[(1S,2S)-3-amino-1-benzyloxy-2-chloro-propyl]thiazol-2-yl]carbamate CAS Name: N-[4-[(1S,2S)-3-amino-2-chloro-1-phenylmethoxypropyl]-2-thiazolyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[(1S,2S)-3-amino-2-chloro-1-phenylmethoxypropyl]-1,3-thiazol-2-yl]carbamate Traditional Name: N-[4-[(1S,2S)-3-amino-1-benzoxy-2-chloro-propyl]thiazol-2-yl]carbamic acid tert-butyl ester Formula: C18H24ClN3O3S MolecularWeight: 397.91946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=NC(=CS1)C(C(CN)Cl)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC1=NC(=CS1)[C@@H]([C@H](CN)Cl)OCC2=CC=CC=C2

InChI

InChI=1S/C18H24ClN3O3S/c1-18(2,3)25-17(23)22-16-21-14(11-26-16)15(13(19)9-20)24-10-12-7-5-4-6-8-12/h4-8,11,13,15H,9-10,20H2,1-3H3,(H,21,22,23)/t13-,15+/m0/s1