ethyl 2-[[5-[(4-chloranylpyrazol-1-yl)methyl]furan-2-yl]carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[5-[(4-chloranylpyrazol-1-yl)methyl]furan-2-yl]carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[5-[(4-chloropyrazol-1-yl)methyl]furan-2-carbonyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[5-[(4-chloro-1-pyrazolyl)methyl]-2-furanyl]-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-[(4-chloropyrazol-1-yl)methyl]furan-2-carbonyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[5-[(4-chloropyrazol-1-yl)methyl]-2-furoyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H18ClN3O4S MolecularWeight: 407.87122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=CC=C(O2)CN3C=C(C=N3)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=CC=C(O2)CN3C=C(C=N3)Cl

InChI

InChI=1S/C18H18ClN3O4S/c1-4-25-18(24)15-10(2)11(3)27-17(15)21-16(23)14-6-5-13(26-14)9-22-8-12(19)7-20-22/h5-8H,4,9H2,1-3H3,(H,21,23)