ethyl 2-[(3-azanyl-6-methyl-thieno[2,3-b]pyridin-2-yl)carbonylamino]-4-(4-bromophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(3-azanyl-6-methyl-thieno[2,3-b]pyridin-2-yl)carbonylamino]-4-(4-bromophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(3-amino-6-methyl-thieno[2,3-b]pyridine-2-carbonyl)amino]-4-(4-bromophenyl)thiophene-3-carboxylate CAS Name: 2-[[(3-amino-6-methyl-2-thieno[2,3-b]pyridinyl)-oxomethyl]amino]-4-(4-bromophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-amino-6-methylthieno[2,3-b]pyridine-2-carbonyl)amino]-4-(4-bromophenyl)thiophene-3-carboxylate Traditional Name: 2-[(3-amino-6-methyl-thieno[2,3-b]pyridine-2-carbonyl)amino]-4-(4-bromophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C22H18BrN3O3S2 MolecularWeight: 516.43062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3=C(C4=C(S3)N=C(C=C4)C)N

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3=C(C4=C(S3)N=C(C=C4)C)N

InChI

InChI=1S/C22H18BrN3O3S2/c1-3-29-22(28)16-15(12-5-7-13(23)8-6-12)10-30-21(16)26-19(27)18-17(24)14-9-4-11(2)25-20(14)31-18/h4-10H,3,24H2,1-2H3,(H,26,27)