tert-butyl (Z)-3-(2-methyl-5-phenyl-thiophen-3-yl)-2-(phenylmethoxycarbonylamino)prop-2-enoate

Systemtic Name: tert-butyl (Z)-3-(2-methyl-5-phenyl-thiophen-3-yl)-2-(phenylmethoxycarbonylamino)prop-2-enoate Openeye Name: tert-butyl (Z)-2-(benzyloxycarbonylamino)-3-(2-methyl-5-phenyl-3-thienyl)prop-2-enoate CAS Name: (Z)-3-(2-methyl-5-phenyl-3-thiophenyl)-2-(phenylmethoxycarbonylamino)-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl (Z)-3-(2-methyl-5-phenylthiophen-3-yl)-2-(phenylmethoxycarbonylamino)prop-2-enoate Traditional Name: (Z)-2-(benzyloxycarbonylamino)-3-(2-methyl-5-phenyl-3-thienyl)acrylic acid tert-butyl ester Formula: C26H27NO4S MolecularWeight: 449.56188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C2=CC=CC=C2)C=C(C(=O)OC(C)(C)C)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(S1)C2=CC=CC=C2)/C=C(/C(=O)OC(C)(C)C)\NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H27NO4S/c1-18-21(16-23(32-18)20-13-9-6-10-14-20)15-22(24(28)31-26(2,3)4)27-25(29)30-17-19-11-7-5-8-12-19/h5-16H,17H2,1-4H3,(H,27,29)/b22-15-