methyl (E)-3-[(2,3-dimethyl-1-benzothiophen-5-yl)sulfanyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate

Systemtic Name: methyl (E)-3-[(2,3-dimethyl-1-benzothiophen-5-yl)sulfanyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate Openeye Name: methyl (E)-2-(tert-butoxycarbonylamino)-3-(2,3-dimethylbenzothiophen-5-yl)sulfanyl-prop-2-enoate CAS Name: (E)-3-[(2,3-dimethyl-1-benzothiophen-5-yl)thio]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[(2,3-dimethyl-1-benzothiophen-5-yl)sulfanyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate Traditional Name: (E)-2-(tert-butoxycarbonylamino)-3-[(2,3-dimethylbenzothiophen-5-yl)thio]acrylic acid methyl ester Formula: C19H23NO4S2 MolecularWeight: 393.52022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)SC=C(C(=O)OC)NC(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)S/C=C(\C(=O)OC)/NC(=O)OC(C)(C)C)C

InChI

InChI=1S/C19H23NO4S2/c1-11-12(2)26-16-8-7-13(9-14(11)16)25-10-15(17(21)23-6)20-18(22)24-19(3,4)5/h7-10H,1-6H3,(H,20,22)/b15-10+