2-[(E)-2-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]ethenyl]-5-methyl-1,3-benzothiazole

Systemtic Name: 2-[(E)-2-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]ethenyl]-5-methyl-1,3-benzothiazole Openeye Name: 2-[(E)-2-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)vinyl]-5-methyl-1,3-benzothiazole CAS Name: 2-[(E)-2-[5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]ethenyl]-5-methyl-1,3-benzothiazole IUPAC Name: 2-[(E)-2-[5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]ethenyl]-5-methyl-1,3-benzothiazole Traditional Name: 2-[(E)-2-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)vinyl]-5-methyl-1,3-benzothiazole Formula: C18H20ClN3S MolecularWeight: 345.8895

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=N2)C=CC3=C(N(N=C3C)CC(C)C)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=N2)/C=C/C3=C(N(N=C3C)CC(C)C)Cl

InChI

InChI=1S/C18H20ClN3S/c1-11(2)10-22-18(19)14(13(4)21-22)6-8-17-20-15-9-12(3)5-7-16(15)23-17/h5-9,11H,10H2,1-4H3/b8-6+