propyl 5-(dimethylcarbamoyl)-2-[3-(4-iodanyl-5-methyl-pyrazol-1-yl)propanoylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: propyl 5-(dimethylcarbamoyl)-2-[3-(4-iodanyl-5-methyl-pyrazol-1-yl)propanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: propyl 5-(dimethylcarbamoyl)-2-[3-(4-iodo-5-methyl-pyrazol-1-yl)propanoylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[dimethylamino(oxo)methyl]-2-[[3-(4-iodo-5-methyl-1-pyrazolyl)-1-oxopropyl]amino]-4-methyl-3-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 5-(dimethylcarbamoyl)-2-[3-(4-iodo-5-methylpyrazol-1-yl)propanoylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-(dimethylcarbamoyl)-2-[3-(4-iodo-5-methyl-pyrazol-1-yl)propanoylamino]-4-methyl-thiophene-3-carboxylic acid propyl ester Formula: C19H25IN4O4S MolecularWeight: 532.39567

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)CCN2C(=C(C=N2)I)C

Isomeric SMILES

CCCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)CCN2C(=C(C=N2)I)C

InChI

InChI=1S/C19H25IN4O4S/c1-6-9-28-19(27)15-11(2)16(18(26)23(4)5)29-17(15)22-14(25)7-8-24-12(3)13(20)10-21-24/h10H,6-9H2,1-5H3,(H,22,25)