ethyl 2-(cyclopropylcarbamothioylamino)-5-(phenylmethyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-(cyclopropylcarbamothioylamino)-5-(phenylmethyl)thiophene-3-carboxylate Openeye Name: ethyl 5-benzyl-2-(cyclopropylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 2-[[(cyclopropylamino)-sulfanylidenemethyl]amino]-5-(phenylmethyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-benzyl-2-(cyclopropylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 5-benzyl-2-(cyclopropylthiocarbamoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C18H20N2O2S2 MolecularWeight: 360.4936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)NC3CC3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)NC3CC3

InChI

InChI=1S/C18H20N2O2S2/c1-2-22-17(21)15-11-14(10-12-6-4-3-5-7-12)24-16(15)20-18(23)19-13-8-9-13/h3-7,11,13H,2,8-10H2,1H3,(H2,19,20,23)