methyl 2-(diethylcarbamothioylamino)-5-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-(diethylcarbamothioylamino)-5-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-(diethylcarbamothioylamino)-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[diethylamino(sulfanylidene)methyl]amino]-5-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(diethylcarbamothioylamino)-5-phenylthiophene-3-carboxylate Traditional Name: 2-(diethylthiocarbamoylamino)-5-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C17H20N2O2S2 MolecularWeight: 348.4829

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)NC1=C(C=C(S1)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CCN(CC)C(=S)NC1=C(C=C(S1)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C17H20N2O2S2/c1-4-19(5-2)17(22)18-15-13(16(20)21-3)11-14(23-15)12-9-7-6-8-10-12/h6-11H,4-5H2,1-3H3,(H,18,22)