methyl 2-(2,3-dihydro-1H-inden-5-ylcarbamothioylamino)-5-ethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-(2,3-dihydro-1H-inden-5-ylcarbamothioylamino)-5-ethyl-thiophene-3-carboxylate Openeye Name: methyl 5-ethyl-2-(indan-5-ylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 2-[[(2,3-dihydro-1H-inden-5-ylamino)-sulfanylidenemethyl]amino]-5-ethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(2,3-dihydro-1H-inden-5-ylcarbamothioylamino)-5-ethylthiophene-3-carboxylate Traditional Name: 5-ethyl-2-(indan-5-ylthiocarbamoylamino)thiophene-3-carboxylic acid methyl ester Formula: C18H20N2O2S2 MolecularWeight: 360.4936

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=S)NC2=CC3=C(CCC3)C=C2)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)NC2=CC3=C(CCC3)C=C2)C(=O)OC

InChI

InChI=1S/C18H20N2O2S2/c1-3-14-10-15(17(21)22-2)16(24-14)20-18(23)19-13-8-7-11-5-4-6-12(11)9-13/h7-10H,3-6H2,1-2H3,(H2,19,20,23)