2-[5-[4-methoxy-3-(oxolan-2-yloxy)phenyl]-3-methyl-pyrazol-1-yl]-1,3-benzothiazole

Systemtic Name: 2-[5-[4-methoxy-3-(oxolan-2-yloxy)phenyl]-3-methyl-pyrazol-1-yl]-1,3-benzothiazole Openeye Name: 2-[5-(4-methoxy-3-tetrahydrofuran-2-yloxy-phenyl)-3-methyl-pyrazol-1-yl]-1,3-benzothiazole CAS Name: 2-[5-[4-methoxy-3-(2-oxolanyloxy)phenyl]-3-methyl-1-pyrazolyl]-1,3-benzothiazole IUPAC Name: 2-[5-[4-methoxy-3-(oxolan-2-yloxy)phenyl]-3-methylpyrazol-1-yl]-1,3-benzothiazole Traditional Name: 2-[5-[4-methoxy-3-(tetrahydrofuryloxy)phenyl]-3-methyl-pyrazol-1-yl]-1,3-benzothiazole Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C2=CC(=C(C=C2)OC)OC3CCCO3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=NN(C(=C1)C2=CC(=C(C=C2)OC)OC3CCCO3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H21N3O3S/c1-14-12-17(25(24-14)22-23-16-6-3-4-7-20(16)29-22)15-9-10-18(26-2)19(13-15)28-21-8-5-11-27-21/h3-4,6-7,9-10,12-13,21H,5,8,11H2,1-2H3