3-(4-chlorophenyl)-2-(4-methoxy-1,3-benzothiazol-2-yl)-5-(3-oxidanylpropyl)-4H-pyrazol-3-ol

Systemtic Name: 3-(4-chlorophenyl)-2-(4-methoxy-1,3-benzothiazol-2-yl)-5-(3-oxidanylpropyl)-4H-pyrazol-3-ol Openeye Name: 3-(4-chlorophenyl)-5-(3-hydroxypropyl)-2-(4-methoxy-1,3-benzothiazol-2-yl)-4H-pyrazol-3-ol CAS Name: 3-(4-chlorophenyl)-5-(3-hydroxypropyl)-2-(4-methoxy-1,3-benzothiazol-2-yl)-4H-pyrazol-3-ol IUPAC Name: 3-(4-chlorophenyl)-5-(3-hydroxypropyl)-2-(4-methoxy-1,3-benzothiazol-2-yl)-4H-pyrazol-3-ol Traditional Name: 3-(4-chlorophenyl)-5-(3-hydroxypropyl)-2-(4-methoxy-1,3-benzothiazol-2-yl)-2-pyrazolin-3-ol Formula: C20H20ClN3O3S MolecularWeight: 417.9091

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC=C1)SC(=N2)N3C(CC(=N3)CCCO)(C4=CC=C(C=C4)Cl)O

Isomeric SMILES

COC1=C2C(=CC=C1)SC(=N2)N3C(CC(=N3)CCCO)(C4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C20H20ClN3O3S/c1-27-16-5-2-6-17-18(16)22-19(28-17)24-20(26,12-15(23-24)4-3-11-25)13-7-9-14(21)10-8-13/h2,5-10,25-26H,3-4,11-12H2,1H3