3-[5-(4-chlorophenyl)-1-(4-methoxy-1,3-benzothiazol-2-yl)pyrazol-3-yl]propan-1-ol

Systemtic Name: 3-[5-(4-chlorophenyl)-1-(4-methoxy-1,3-benzothiazol-2-yl)pyrazol-3-yl]propan-1-ol Openeye Name: 3-[5-(4-chlorophenyl)-1-(4-methoxy-1,3-benzothiazol-2-yl)pyrazol-3-yl]propan-1-ol CAS Name: 3-[5-(4-chlorophenyl)-1-(4-methoxy-1,3-benzothiazol-2-yl)-3-pyrazolyl]-1-propanol IUPAC Name: 3-[5-(4-chlorophenyl)-1-(4-methoxy-1,3-benzothiazol-2-yl)pyrazol-3-yl]propan-1-ol Traditional Name: 3-[5-(4-chlorophenyl)-1-(4-methoxy-1,3-benzothiazol-2-yl)pyrazol-3-yl]propan-1-ol Formula: C20H18ClN3O2S MolecularWeight: 399.89382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18ClN3O2S/c1-26-17-5-2-6-18-19(17)22-20(27-18)24-16(12-15(23-24)4-3-11-25)13-7-9-14(21)10-8-13/h2,5-10,12,25H,3-4,11H2,1H3