ethyl 5-[(3-azanylthieno[2,3-b]pyridin-2-yl)carbonylamino]-2-chloranyl-benzoate

Systemtic Name: ethyl 5-[(3-azanylthieno[2,3-b]pyridin-2-yl)carbonylamino]-2-chloranyl-benzoate Openeye Name: ethyl 5-[(3-aminothieno[2,3-b]pyridine-2-carbonyl)amino]-2-chloro-benzoate CAS Name: 5-[[(3-amino-2-thieno[2,3-b]pyridinyl)-oxomethyl]amino]-2-chlorobenzoic acid ethyl ester IUPAC Name: ethyl 5-[(3-aminothieno[2,3-b]pyridine-2-carbonyl)amino]-2-chlorobenzoate Traditional Name: 5-[(3-aminothieno[2,3-b]pyridine-2-carbonyl)amino]-2-chloro-benzoic acid ethyl ester Formula: C17H14ClN3O3S MolecularWeight: 375.82936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)NC(=O)C2=C(C3=C(S2)N=CC=C3)N)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)NC(=O)C2=C(C3=C(S2)N=CC=C3)N)Cl

InChI

InChI=1S/C17H14ClN3O3S/c1-2-24-17(23)11-8-9(5-6-12(11)18)21-15(22)14-13(19)10-4-3-7-20-16(10)25-14/h3-8H,2,19H2,1H3,(H,21,22)