2-(4-butyl-3,5-dimethyl-pyrazol-1-yl)-6-methyl-1,3-benzothiazole

Systemtic Name: 2-(4-butyl-3,5-dimethyl-pyrazol-1-yl)-6-methyl-1,3-benzothiazole Openeye Name: 2-(4-butyl-3,5-dimethyl-pyrazol-1-yl)-6-methyl-1,3-benzothiazole CAS Name: 2-(4-butyl-3,5-dimethyl-1-pyrazolyl)-6-methyl-1,3-benzothiazole IUPAC Name: 2-(4-butyl-3,5-dimethylpyrazol-1-yl)-6-methyl-1,3-benzothiazole Traditional Name: 2-(4-butyl-3,5-dimethyl-pyrazol-1-yl)-6-methyl-1,3-benzothiazole Formula: C17H21N3S MolecularWeight: 299.43374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(N=C1C)C2=NC3=C(S2)C=C(C=C3)C)C

Isomeric SMILES

CCCCC1=C(N(N=C1C)C2=NC3=C(S2)C=C(C=C3)C)C

InChI

InChI=1S/C17H21N3S/c1-5-6-7-14-12(3)19-20(13(14)4)17-18-15-9-8-11(2)10-16(15)21-17/h8-10H,5-7H2,1-4H3