2-bromanyl-4-[(4-oxidanylcyclohexyl)amino]thieno[3,2-c]pyridine-7-carboxylic acid

Systemtic Name: 2-bromanyl-4-[(4-oxidanylcyclohexyl)amino]thieno[3,2-c]pyridine-7-carboxylic acid Openeye Name: 2-bromo-4-[(4-hydroxycyclohexyl)amino]thieno[3,2-c]pyridine-7-carboxylic acid CAS Name: 2-bromo-4-[(4-hydroxycyclohexyl)amino]-7-thieno[3,2-c]pyridinecarboxylic acid IUPAC Name: 2-bromo-4-[(4-hydroxycyclohexyl)amino]thieno[3,2-c]pyridine-7-carboxylic acid Traditional Name: 2-bromo-4-[(4-hydroxycyclohexyl)amino]thieno[3,2-c]pyridine-7-carboxylic acid Formula: C14H15BrN2O3S MolecularWeight: 371.2495

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=NC=C(C3=C2C=C(S3)Br)C(=O)O)O

Isomeric SMILES

C1CC(CCC1NC2=NC=C(C3=C2C=C(S3)Br)C(=O)O)O

InChI

InChI=1S/C14H15BrN2O3S/c15-11-5-9-12(21-11)10(14(19)20)6-16-13(9)17-7-1-3-8(18)4-2-7/h5-8,18H,1-4H2,(H,16,17)(H,19,20)