methyl 5-methyl-2-(pentan-3-ylcarbamothioylamino)-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-2-(pentan-3-ylcarbamothioylamino)-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-(1-ethylpropylcarbamothioylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-[[(pentan-3-ylamino)-sulfanylidenemethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-(pentan-3-ylcarbamothioylamino)-4-phenylthiophene-3-carboxylate Traditional Name: 2-(1-ethylpropylthiocarbamoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C19H24N2O2S2 MolecularWeight: 376.53606

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=S)NC1=C(C(=C(S1)C)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CCC(CC)NC(=S)NC1=C(C(=C(S1)C)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C19H24N2O2S2/c1-5-14(6-2)20-19(24)21-17-16(18(22)23-4)15(12(3)25-17)13-10-8-7-9-11-13/h7-11,14H,5-6H2,1-4H3,(H2,20,21,24)