ethyl 5-azanyl-4-cyano-3-(cyclopentylsulfanylmethyl)thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-(cyclopentylsulfanylmethyl)thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-(cyclopentylsulfanylmethyl)thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[(cyclopentylthio)methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-(cyclopentylsulfanylmethyl)thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(cyclopentylthio)methyl]thiophene-2-carboxylic acid ethyl ester Formula: C14H18N2O2S2 MolecularWeight: 310.43492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2CCCC2

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2CCCC2

InChI

InChI=1S/C14H18N2O2S2/c1-2-18-14(17)12-11(10(7-15)13(16)20-12)8-19-9-5-3-4-6-9/h9H,2-6,8,16H2,1H3