ethyl 3-azanyl-6-azanylidene-4-(4-chlorophenyl)-5-cyano-thieno[2,3-b]thiopyran-2-carboxylate

Systemtic Name: ethyl 3-azanyl-6-azanylidene-4-(4-chlorophenyl)-5-cyano-thieno[2,3-b]thiopyran-2-carboxylate Openeye Name: ethyl 3-amino-4-(4-chlorophenyl)-5-cyano-6-imino-thieno[2,3-b]thiopyran-2-carboxylate CAS Name: 3-amino-4-(4-chlorophenyl)-5-cyano-6-imino-2-thieno[2,3-b]thiopyrancarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-4-(4-chlorophenyl)-5-cyano-6-iminothieno[2,3-b]thiopyran-2-carboxylate Traditional Name: 3-amino-4-(4-chlorophenyl)-5-cyano-6-imino-thieno[2,3-b]thiopyran-2-carboxylic acid ethyl ester Formula: C17H12ClN3O2S2 MolecularWeight: 389.87908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)SC(=N)C(=C2C3=CC=C(C=C3)Cl)C#N)N

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)SC(=N)C(=C2C3=CC=C(C=C3)Cl)C#N)N

InChI

InChI=1S/C17H12ClN3O2S2/c1-2-23-16(22)14-13(20)12-11(8-3-5-9(18)6-4-8)10(7-19)15(21)25-17(12)24-14/h3-6,21H,2,20H2,1H3