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

Systemtic Name: methyl 2-(2,3-dihydro-1H-inden-5-ylcarbamothioylamino)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-(indan-5-ylcarbamothioylamino)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(2,3-dihydro-1H-inden-5-ylamino)-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(2,3-dihydro-1H-inden-5-ylcarbamothioylamino)-5-methylthiophene-3-carboxylate Traditional Name: 2-(indan-5-ylthiocarbamoylamino)-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C17H18N2O2S2 MolecularWeight: 346.46702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=S)NC2=CC3=C(CCC3)C=C2)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=S)NC2=CC3=C(CCC3)C=C2)C(=O)OC

InChI

InChI=1S/C17H18N2O2S2/c1-10-8-14(16(20)21-2)15(23-10)19-17(22)18-13-7-6-11-4-3-5-12(11)9-13/h6-9H,3-5H2,1-2H3,(H2,18,19,22)