2-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]carbamothioylamino]-4-ethyl-5-methyl-thiophene-3-carboxamide

Systemtic Name: 2-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]carbamothioylamino]-4-ethyl-5-methyl-thiophene-3-carboxamide Openeye Name: 2-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]carbamothioylamino]-4-ethyl-5-methyl-thiophene-3-carboxamide CAS Name: 2-[[[[(E)-3-(4-ethoxyphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-4-ethyl-5-methyl-3-thiophenecarboxamide IUPAC Name: 2-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]carbamothioylamino]-4-ethyl-5-methylthiophene-3-carboxamide Traditional Name: 4-ethyl-5-methyl-2-[[(E)-3-p-phenetylacryloyl]thiocarbamoylamino]thiophene-3-carboxamide Formula: C20H23N3O3S2 MolecularWeight: 417.54492

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C=CC2=CC=C(C=C2)OCC)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)/C=C/C2=CC=C(C=C2)OCC)C

InChI

InChI=1S/C20H23N3O3S2/c1-4-15-12(3)28-19(17(15)18(21)25)23-20(27)22-16(24)11-8-13-6-9-14(10-7-13)26-5-2/h6-11H,4-5H2,1-3H3,(H2,21,25)(H2,22,23,24,27)/b11-8+