methyl (Z)-3-(2,3-dimethyl-1-benzothiophen-7-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]but-2-enoate

Systemtic Name: methyl (Z)-3-(2,3-dimethyl-1-benzothiophen-7-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]but-2-enoate Openeye Name: methyl (Z)-2-(tert-butoxycarbonylamino)-3-(2,3-dimethylbenzothiophen-7-yl)but-2-enoate CAS Name: (Z)-3-(2,3-dimethyl-1-benzothiophen-7-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-butenoic acid methyl ester IUPAC Name: methyl (Z)-3-(2,3-dimethyl-1-benzothiophen-7-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]but-2-enoate Traditional Name: (Z)-2-(tert-butoxycarbonylamino)-3-(2,3-dimethylbenzothiophen-7-yl)but-2-enoic acid methyl ester Formula: C20H25NO4S MolecularWeight: 375.4818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=CC=C2C(=C(C(=O)OC)NC(=O)OC(C)(C)C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO4S/c1-11-13(3)26-17-14(11)9-8-10-15(17)12(2)16(18(22)24-7)21-19(23)25-20(4,5)6/h8-10H,1-7H3,(H,21,23)/b16-12-