4-azanyl-2-[4-(2-cyanoethyl)-5-methyl-thiophen-2-yl]thieno[3,2-c]pyridine-7-carboxylic acid

Systemtic Name: 4-azanyl-2-[4-(2-cyanoethyl)-5-methyl-thiophen-2-yl]thieno[3,2-c]pyridine-7-carboxylic acid Openeye Name: 4-amino-2-[4-(2-cyanoethyl)-5-methyl-2-thienyl]thieno[3,2-c]pyridine-7-carboxylic acid CAS Name: 4-amino-2-[4-(2-cyanoethyl)-5-methyl-2-thiophenyl]-7-thieno[3,2-c]pyridinecarboxylic acid IUPAC Name: 4-amino-2-[4-(2-cyanoethyl)-5-methylthiophen-2-yl]thieno[3,2-c]pyridine-7-carboxylic acid Traditional Name: 4-amino-2-[4-(2-cyanoethyl)-5-methyl-2-thienyl]thieno[3,2-c]pyridine-7-carboxylic acid Formula: C16H13N3O2S2 MolecularWeight: 343.42332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C2=CC3=C(S2)C(=CN=C3N)C(=O)O)CCC#N

Isomeric SMILES

CC1=C(C=C(S1)C2=CC3=C(S2)C(=CN=C3N)C(=O)O)CCC#N

InChI

InChI=1S/C16H13N3O2S2/c1-8-9(3-2-4-17)5-12(22-8)13-6-10-14(23-13)11(16(20)21)7-19-15(10)18/h5-7H,2-3H2,1H3,(H2,18,19)(H,20,21)