methyl 2-[(4-chloranyl-2-methyl-pyrazol-3-yl)carbonylamino]-5-(1-phenylethyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[(4-chloranyl-2-methyl-pyrazol-3-yl)carbonylamino]-5-(1-phenylethyl)thiophene-3-carboxylate Openeye Name: methyl 2-[(4-chloro-2-methyl-pyrazole-3-carbonyl)amino]-5-(1-phenylethyl)thiophene-3-carboxylate CAS Name: 2-[[(4-chloro-2-methyl-3-pyrazolyl)-oxomethyl]amino]-5-(1-phenylethyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-chloro-2-methylpyrazole-3-carbonyl)amino]-5-(1-phenylethyl)thiophene-3-carboxylate Traditional Name: 2-[(4-chloro-2-methyl-pyrazole-3-carbonyl)amino]-5-(1-phenylethyl)thiophene-3-carboxylic acid methyl ester Formula: C19H18ClN3O3S MolecularWeight: 403.88252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C2=CC(=C(S2)NC(=O)C3=C(C=NN3C)Cl)C(=O)OC

Isomeric SMILES

CC(C1=CC=CC=C1)C2=CC(=C(S2)NC(=O)C3=C(C=NN3C)Cl)C(=O)OC

InChI

InChI=1S/C19H18ClN3O3S/c1-11(12-7-5-4-6-8-12)15-9-13(19(25)26-3)18(27-15)22-17(24)16-14(20)10-21-23(16)2/h4-11H,1-3H3,(H,22,24)