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

Systemtic Name: ethyl 5-azanyl-4-cyano-3-(quinolin-2-ylsulfanylmethyl)thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-(2-quinolylsulfanylmethyl)thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[(2-quinolinylthio)methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-(quinolin-2-ylsulfanylmethyl)thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(2-quinolylthio)methyl]thiophene-2-carboxylic acid ethyl ester Formula: C18H15N3O2S2 MolecularWeight: 369.4606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H15N3O2S2/c1-2-23-18(22)16-13(12(9-19)17(20)25-16)10-24-15-8-7-11-5-3-4-6-14(11)21-15/h3-8H,2,10,20H2,1H3