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

Systemtic Name: methyl 2-[(3-azanyl-6-methyl-thieno[2,3-b]pyridin-2-yl)carbonylamino]-4-(4-bromophenyl)thiophene-3-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C21H16BrN3O3S2 MolecularWeight: 502.40404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=C(S2)C(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)Br)C(=O)OC)N

Isomeric SMILES

CC1=NC2=C(C=C1)C(=C(S2)C(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)Br)C(=O)OC)N

InChI

InChI=1S/C21H16BrN3O3S2/c1-10-3-8-13-16(23)17(30-19(13)24-10)18(26)25-20-15(21(27)28-2)14(9-29-20)11-4-6-12(22)7-5-11/h3-9H,23H2,1-2H3,(H,25,26)