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

Systemtic Name: 4-ethyl-5-methyl-2-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]thiophene-3-carboxamide Openeye Name: 4-ethyl-5-methyl-2-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]thiophene-3-carboxamide CAS Name: 4-ethyl-5-methyl-2-[[[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxamide IUPAC Name: 4-ethyl-5-methyl-2-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]thiophene-3-carboxamide Traditional Name: 4-ethyl-5-methyl-2-[[(E)-3-phenylacryloyl]thiocarbamoylamino]thiophene-3-carboxamide Formula: C18H19N3O2S2 MolecularWeight: 373.49236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O2S2/c1-3-13-11(2)25-17(15(13)16(19)23)21-18(24)20-14(22)10-9-12-7-5-4-6-8-12/h4-10H,3H2,1-2H3,(H2,19,23)(H2,20,21,22,24)/b10-9+