5-(2-azanyl-3-propan-2-ylsulfonyl-benzimidazol-5-yl)-4-(4-fluorophenyl)-2-phenyl-1H-pyrazol-3-one

Systemtic Name: 5-(2-azanyl-3-propan-2-ylsulfonyl-benzimidazol-5-yl)-4-(4-fluorophenyl)-2-phenyl-1H-pyrazol-3-one Openeye Name: 5-(2-amino-3-isopropylsulfonyl-benzimidazol-5-yl)-4-(4-fluorophenyl)-2-phenyl-1H-pyrazol-3-one CAS Name: 5-(2-amino-3-propan-2-ylsulfonyl-5-benzimidazolyl)-4-(4-fluorophenyl)-2-phenyl-1H-pyrazol-3-one IUPAC Name: 5-(2-amino-3-propan-2-ylsulfonylbenzimidazol-5-yl)-4-(4-fluorophenyl)-2-phenyl-1H-pyrazol-3-one Traditional Name: 5-(2-amino-3-isopropylsulfonyl-benzimidazol-5-yl)-4-(4-fluorophenyl)-2-phenyl-3-pyrazolin-3-one Formula: C25H22FN5O3S MolecularWeight: 491.537283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C3=C(C(=O)N(N3)C4=CC=CC=C4)C5=CC=C(C=C5)F)N=C1N

Isomeric SMILES

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C3=C(C(=O)N(N3)C4=CC=CC=C4)C5=CC=C(C=C5)F)N=C1N

InChI

InChI=1S/C25H22FN5O3S/c1-15(2)35(33,34)31-21-14-17(10-13-20(21)28-25(31)27)23-22(16-8-11-18(26)12-9-16)24(32)30(29-23)19-6-4-3-5-7-19/h3-15,29H,1-2H3,(H2,27,28)