1-[(3S)-5-(4-bromophenyl)-3-(1-methylindol-3-yl)-1,3-dihydropyrazol-2-yl]ethanone

Systemtic Name: 1-[(3S)-5-(4-bromophenyl)-3-(1-methylindol-3-yl)-1,3-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[(3S)-5-(4-bromophenyl)-3-(1-methylindol-3-yl)-1,3-dihydropyrazol-2-yl]ethanone CAS Name: 1-[(3S)-5-(4-bromophenyl)-3-(1-methyl-3-indolyl)-1,3-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[(3S)-5-(4-bromophenyl)-3-(1-methylindol-3-yl)-1,3-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[(5S)-3-(4-bromophenyl)-5-(1-methylindol-3-yl)-3-pyrazolin-1-yl]ethanone Formula: C20H18BrN3O MolecularWeight: 396.28042

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C=C(N1)C2=CC=C(C=C2)Br)C3=CN(C4=CC=CC=C43)C

Isomeric SMILES

CC(=O)N1[C@@H](C=C(N1)C2=CC=C(C=C2)Br)C3=CN(C4=CC=CC=C43)C

InChI

InChI=1S/C20H18BrN3O/c1-13(25)24-20(11-18(22-24)14-7-9-15(21)10-8-14)17-12-23(2)19-6-4-3-5-16(17)19/h3-12,20,22H,1-2H3/t20-/m0/s1