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

Systemtic Name: ethyl 2-(cyclopentylcarbamothioylamino)-5-(phenylmethyl)thiophene-3-carboxylate Openeye Name: ethyl 5-benzyl-2-(cyclopentylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 2-[[(cyclopentylamino)-sulfanylidenemethyl]amino]-5-(phenylmethyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-benzyl-2-(cyclopentylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 5-benzyl-2-(cyclopentylthiocarbamoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C20H24N2O2S2 MolecularWeight: 388.54676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)NC3CCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)NC3CCCC3

InChI

InChI=1S/C20H24N2O2S2/c1-2-24-19(23)17-13-16(12-14-8-4-3-5-9-14)26-18(17)22-20(25)21-15-10-6-7-11-15/h3-5,8-9,13,15H,2,6-7,10-12H2,1H3,(H2,21,22,25)