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

Systemtic Name: methyl 4-[[3-azanyl-4-(4-methoxyphenyl)-6-phenyl-thieno[2,3-b]pyridin-2-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[3-amino-4-(4-methoxyphenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carbonyl]amino]benzoate CAS Name: 4-[[[3-amino-4-(4-methoxyphenyl)-6-phenyl-2-thieno[2,3-b]pyridinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-amino-4-(4-methoxyphenyl)-6-phenylthieno[2,3-b]pyridine-2-carbonyl]amino]benzoate Traditional Name: 4-[[3-amino-4-(4-methoxyphenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carbonyl]amino]benzoic acid methyl ester Formula: C29H23N3O4S MolecularWeight: 509.57562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC3=C2C(=C(S3)C(=O)NC4=CC=C(C=C4)C(=O)OC)N)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC3=C2C(=C(S3)C(=O)NC4=CC=C(C=C4)C(=O)OC)N)C5=CC=CC=C5

InChI

InChI=1S/C29H23N3O4S/c1-35-21-14-10-17(11-15-21)22-16-23(18-6-4-3-5-7-18)32-28-24(22)25(30)26(37-28)27(33)31-20-12-8-19(9-13-20)29(34)36-2/h3-16H,30H2,1-2H3,(H,31,33)