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

Systemtic Name: 3-chloranyl-N-[1-[2-(3,4-dimethoxyphenyl)ethyl]pyrazol-4-yl]-4-methylsulfonyl-thiophene-2-carboxamide Openeye Name: 3-chloro-N-[1-[2-(3,4-dimethoxyphenyl)ethyl]pyrazol-4-yl]-4-methylsulfonyl-thiophene-2-carboxamide CAS Name: 3-chloro-N-[1-[2-(3,4-dimethoxyphenyl)ethyl]-4-pyrazolyl]-4-methylsulfonyl-2-thiophenecarboxamide IUPAC Name: 3-chloro-N-[1-[2-(3,4-dimethoxyphenyl)ethyl]pyrazol-4-yl]-4-methylsulfonylthiophene-2-carboxamide Traditional Name: 3-chloro-N-(1-homoveratrylpyrazol-4-yl)-4-mesyl-thiophene-2-carboxamide Formula: C19H20ClN3O5S2 MolecularWeight: 469.9622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C=C(C=N2)NC(=O)C3=C(C(=CS3)S(=O)(=O)C)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C=C(C=N2)NC(=O)C3=C(C(=CS3)S(=O)(=O)C)Cl)OC

InChI

InChI=1S/C19H20ClN3O5S2/c1-27-14-5-4-12(8-15(14)28-2)6-7-23-10-13(9-21-23)22-19(24)18-17(20)16(11-29-18)30(3,25)26/h4-5,8-11H,6-7H2,1-3H3,(H,22,24)