2-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-4-ethyl-5-methyl-thiophene-3-carboxamide

Systemtic Name: 2-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-4-ethyl-5-methyl-thiophene-3-carboxamide Openeye Name: 2-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-4-ethyl-5-methyl-thiophene-3-carboxamide CAS Name: 2-[[[[3-(2-chlorophenyl)-1-oxopropyl]amino]-sulfanylidenemethyl]amino]-4-ethyl-5-methyl-3-thiophenecarboxamide IUPAC Name: 2-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-4-ethyl-5-methylthiophene-3-carboxamide Traditional Name: 2-[3-(2-chlorophenyl)propanoylthiocarbamoylamino]-4-ethyl-5-methyl-thiophene-3-carboxamide Formula: C18H20ClN3O2S2 MolecularWeight: 409.9533

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)CCC2=CC=CC=C2Cl)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)CCC2=CC=CC=C2Cl)C

InChI

InChI=1S/C18H20ClN3O2S2/c1-3-12-10(2)26-17(15(12)16(20)24)22-18(25)21-14(23)9-8-11-6-4-5-7-13(11)19/h4-7H,3,8-9H2,1-2H3,(H2,20,24)(H2,21,22,23,25)