3-(4-bromanylpyrazol-1-yl)-N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]propanamide

Systemtic Name: 3-(4-bromanylpyrazol-1-yl)-N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]propanamide Openeye Name: 3-(4-bromopyrazol-1-yl)-N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]propanamide CAS Name: 3-(4-bromo-1-pyrazolyl)-N-[3-(4-chlorophenyl)sulfonyl-5-methoxyphenyl]propanamide IUPAC Name: 3-(4-bromopyrazol-1-yl)-N-[3-(4-chlorophenyl)sulfonyl-5-methoxyphenyl]propanamide Traditional Name: 3-(4-bromopyrazol-1-yl)-N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]propionamide Formula: C19H17BrClN3O4S MolecularWeight: 498.77798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CCN2C=C(C=N2)Br)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CCN2C=C(C=N2)Br)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H17BrClN3O4S/c1-28-16-8-15(23-19(25)6-7-24-12-13(20)11-22-24)9-18(10-16)29(26,27)17-4-2-14(21)3-5-17/h2-5,8-12H,6-7H2,1H3,(H,23,25)