tert-butyl (E,4R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylsulfanyl-pent-2-enoate

Systemtic Name: tert-butyl (E,4R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylsulfanyl-pent-2-enoate Openeye Name: tert-butyl (E,4R)-4-(tert-butoxycarbonylamino)-5-phenylsulfanyl-pent-2-enoate CAS Name: (E,4R)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-(phenylthio)-2-pentenoic acid tert-butyl ester IUPAC Name: tert-butyl (E,4R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylsulfanylpent-2-enoate Traditional Name: (E,4R)-4-(tert-butoxycarbonylamino)-5-(phenylthio)pent-2-enoic acid tert-butyl ester Formula: C20H29NO4S MolecularWeight: 379.51356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C=CC(CSC1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/[C@H](CSC1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H29NO4S/c1-19(2,3)24-17(22)13-12-15(21-18(23)25-20(4,5)6)14-26-16-10-8-7-9-11-16/h7-13,15H,14H2,1-6H3,(H,21,23)/b13-12+/t15-/m1/s1