ethyl 5-azanyl-4-cyano-3-[(4-phenyl-1,3-thiazol-2-yl)sulfanylmethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(4-phenyl-1,3-thiazol-2-yl)sulfanylmethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(4-phenylthiazol-2-yl)sulfanylmethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[(4-phenyl-2-thiazolyl)thio]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(4-phenyl-1,3-thiazol-2-yl)sulfanylmethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[(4-phenylthiazol-2-yl)thio]methyl]thiophene-2-carboxylic acid ethyl ester Formula: C18H15N3O2S3 MolecularWeight: 401.5256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C18H15N3O2S3/c1-2-23-17(22)15-13(12(8-19)16(20)26-15)9-24-18-21-14(10-25-18)11-6-4-3-5-7-11/h3-7,10H,2,9,20H2,1H3