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

Systemtic Name: propan-2-yl 5-aminocarbonyl-2-[2-(4-bromanyl-3-methyl-pyrazol-1-yl)ethanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C16H19BrN4O4S MolecularWeight: 443.31546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19BrN4O4S/c1-7(2)25-16(24)12-8(3)13(14(18)23)26-15(12)19-11(22)6-21-5-10(17)9(4)20-21/h5,7H,6H2,1-4H3,(H2,18,23)(H,19,22)