ethyl 5-azanyl-4-cyano-3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]methyl]thiophene-2-carboxylic acid ethyl ester Formula: C17H16N4O2S3 MolecularWeight: 404.52954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2=NC=NC3=C2C(=C(S3)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2=NC=NC3=C2C(=C(S3)C)C

InChI

InChI=1S/C17H16N4O2S3/c1-4-23-17(22)13-11(10(5-18)14(19)26-13)6-24-15-12-8(2)9(3)25-16(12)21-7-20-15/h7H,4,6,19H2,1-3H3