[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] (Z)-3-(4-methoxyphenyl)-2-thiophen-2-yl-prop-2-enoate

Systemtic Name: [2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] (Z)-3-(4-methoxyphenyl)-2-thiophen-2-yl-prop-2-enoate Openeye Name: [2-(1,1-dimethylpropylamino)-2-oxo-ethyl] (Z)-3-(4-methoxyphenyl)-2-(2-thienyl)prop-2-enoate CAS Name: (Z)-3-(4-methoxyphenyl)-2-thiophen-2-yl-2-propenoic acid [2-(2-methylbutan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylbutan-2-ylamino)-2-oxoethyl] (Z)-3-(4-methoxyphenyl)-2-thiophen-2-ylprop-2-enoate Traditional Name: (Z)-3-(4-methoxyphenyl)-2-(2-thienyl)acrylic acid [2-(tert-amylamino)-2-keto-ethyl] ester Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)COC(=O)C(=CC1=CC=C(C=C1)OC)C2=CC=CS2

Isomeric SMILES

CCC(C)(C)NC(=O)COC(=O)/C(=C/C1=CC=C(C=C1)OC)/C2=CC=CS2

InChI

InChI=1S/C21H25NO4S/c1-5-21(2,3)22-19(23)14-26-20(24)17(18-7-6-12-27-18)13-15-8-10-16(25-4)11-9-15/h6-13H,5,14H2,1-4H3,(H,22,23)/b17-13+