4-[(3-azanyl-6-phenyl-thieno[2,3-b]pyridin-2-yl)carbonylamino]benzoate

Systemtic Name: 4-[(3-azanyl-6-phenyl-thieno[2,3-b]pyridin-2-yl)carbonylamino]benzoate Openeye Name: 4-[(3-amino-6-phenyl-thieno[2,3-b]pyridine-2-carbonyl)amino]benzoate CAS Name: 4-[[(3-amino-6-phenyl-2-thieno[2,3-b]pyridinyl)-oxomethyl]amino]benzoate IUPAC Name: 4-[(3-amino-6-phenylthieno[2,3-b]pyridine-2-carbonyl)amino]benzoate Traditional Name: 4-[(3-amino-6-phenyl-thieno[2,3-b]pyridine-2-carbonyl)amino]benzoate Formula: C21H14N3O3S- MolecularWeight: 388.41916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C=C2)C(=C(S3)C(=O)NC4=CC=C(C=C4)C(=O)[O-])N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=C2)C(=C(S3)C(=O)NC4=CC=C(C=C4)C(=O)[O-])N

InChI

InChI=1S/C21H15N3O3S/c22-17-15-10-11-16(12-4-2-1-3-5-12)24-20(15)28-18(17)19(25)23-14-8-6-13(7-9-14)21(26)27/h1-11H,22H2,(H,23,25)(H,26,27)/p-1