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

Systemtic Name: S-[2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]ethyl] ethanethioate Openeye Name: S-[2-[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]ethyl] ester IUPAC Name: S-[2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]ethyl] ester Formula: C18H26N2O4S MolecularWeight: 366.47504

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCNC(=O)C(CC1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O4S/c1-13(21)25-11-10-19-16(22)15(12-14-8-6-5-7-9-14)20-17(23)24-18(2,3)4/h5-9,15H,10-12H2,1-4H3,(H,19,22)(H,20,23)/t15-/m0/s1