3-chloranyl-N-[1-[(2,3-dimethoxyphenyl)methyl]pyrazol-4-yl]-4-methylsulfonyl-thiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[1-[(2,3-dimethoxyphenyl)methyl]pyrazol-4-yl]-4-methylsulfonyl-thiophene-2-carboxamide Openeye Name: 3-chloro-N-[1-[(2,3-dimethoxyphenyl)methyl]pyrazol-4-yl]-4-methylsulfonyl-thiophene-2-carboxamide CAS Name: 3-chloro-N-[1-[(2,3-dimethoxyphenyl)methyl]-4-pyrazolyl]-4-methylsulfonyl-2-thiophenecarboxamide IUPAC Name: 3-chloro-N-[1-[(2,3-dimethoxyphenyl)methyl]pyrazol-4-yl]-4-methylsulfonylthiophene-2-carboxamide Traditional Name: 3-chloro-4-mesyl-N-(1-o-veratrylpyrazol-4-yl)thiophene-2-carboxamide Formula: C18H18ClN3O5S2 MolecularWeight: 455.93562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN2C=C(C=N2)NC(=O)C3=C(C(=CS3)S(=O)(=O)C)Cl

Isomeric SMILES

COC1=CC=CC(=C1OC)CN2C=C(C=N2)NC(=O)C3=C(C(=CS3)S(=O)(=O)C)Cl

InChI

InChI=1S/C18H18ClN3O5S2/c1-26-13-6-4-5-11(16(13)27-2)8-22-9-12(7-20-22)21-18(23)17-15(19)14(10-28-17)29(3,24)25/h4-7,9-10H,8H2,1-3H3,(H,21,23)