ethyl 2-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]sulfanylethanoate

Systemtic Name: ethyl 2-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]sulfanylethanoate Openeye Name: ethyl 2-[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]sulfanylacetate CAS Name: 2-[[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]sulfanylacetate Traditional Name: 2-[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]thio]acetic acid ethyl ester Formula: C18H25NO5S MolecularWeight: 367.4598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(=O)C(CC1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CSC(=O)[C@H](CC1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C18H25NO5S/c1-5-23-15(20)12-25-16(21)14(11-13-9-7-6-8-10-13)19-17(22)24-18(2,3)4/h6-10,14H,5,11-12H2,1-4H3,(H,19,22)/t14-/m0/s1