N-[(1S)-1-[1-(4-methoxyphenyl)-5-methyl-pyrazol-4-yl]ethyl]quinoline-8-sulfonamide

Systemtic Name: N-[(1S)-1-[1-(4-methoxyphenyl)-5-methyl-pyrazol-4-yl]ethyl]quinoline-8-sulfonamide Openeye Name: N-[(1S)-1-[1-(4-methoxyphenyl)-5-methyl-pyrazol-4-yl]ethyl]quinoline-8-sulfonamide CAS Name: N-[(1S)-1-[1-(4-methoxyphenyl)-5-methyl-4-pyrazolyl]ethyl]-8-quinolinesulfonamide IUPAC Name: N-[(1S)-1-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]ethyl]quinoline-8-sulfonamide Traditional Name: N-[(1S)-1-[1-(4-methoxyphenyl)-5-methyl-pyrazol-4-yl]ethyl]quinoline-8-sulfonamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)OC)C(C)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)OC)[C@H](C)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C22H22N4O3S/c1-15(20-14-24-26(16(20)2)18-9-11-19(29-3)12-10-18)25-30(27,28)21-8-4-6-17-7-5-13-23-22(17)21/h4-15,25H,1-3H3/t15-/m0/s1