methyl 5-aminocarbonyl-2-[2-(4-bromanyl-3-methyl-pyrazol-1-yl)ethanoylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-aminocarbonyl-2-[2-(4-bromanyl-3-methyl-pyrazol-1-yl)ethanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(4-bromo-3-methyl-pyrazol-1-yl)acetyl]amino]-5-carbamoyl-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-(4-bromo-3-methyl-1-pyrazolyl)-1-oxoethyl]amino]-5-carbamoyl-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(4-bromo-3-methylpyrazol-1-yl)acetyl]amino]-5-carbamoyl-4-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(4-bromo-3-methyl-pyrazol-1-yl)acetyl]amino]-5-carbamoyl-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C14H15BrN4O4S MolecularWeight: 415.2623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2C=C(C(=N2)C)Br)C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2C=C(C(=N2)C)Br)C(=O)N

InChI

InChI=1S/C14H15BrN4O4S/c1-6-10(14(22)23-3)13(24-11(6)12(16)21)17-9(20)5-19-4-8(15)7(2)18-19/h4H,5H2,1-3H3,(H2,16,21)(H,17,20)