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

Systemtic Name: ethyl 4-[[3-azanyl-4-(methoxymethyl)-6-methyl-thieno[2,3-b]pyridin-2-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[3-amino-4-(methoxymethyl)-6-methyl-thieno[2,3-b]pyridine-2-carbonyl]amino]benzoate CAS Name: 4-[[[3-amino-4-(methoxymethyl)-6-methyl-2-thieno[2,3-b]pyridinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-amino-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridine-2-carbonyl]amino]benzoate Traditional Name: 4-[[3-amino-4-(methoxymethyl)-6-methyl-thieno[2,3-b]pyridine-2-carbonyl]amino]benzoic acid ethyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(C=C3COC)C)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(C=C3COC)C)N

InChI

InChI=1S/C20H21N3O4S/c1-4-27-20(25)12-5-7-14(8-6-12)23-18(24)17-16(21)15-13(10-26-3)9-11(2)22-19(15)28-17/h5-9H,4,10,21H2,1-3H3,(H,23,24)