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

Systemtic Name: 2-(4-butyl-3,5-dimethyl-pyrazol-1-yl)-6-chloranyl-1,3-benzothiazole Openeye Name: 2-(4-butyl-3,5-dimethyl-pyrazol-1-yl)-6-chloro-1,3-benzothiazole CAS Name: 2-(4-butyl-3,5-dimethyl-1-pyrazolyl)-6-chloro-1,3-benzothiazole IUPAC Name: 2-(4-butyl-3,5-dimethylpyrazol-1-yl)-6-chloro-1,3-benzothiazole Traditional Name: 2-(4-butyl-3,5-dimethyl-pyrazol-1-yl)-6-chloro-1,3-benzothiazole Formula: C16H18ClN3S MolecularWeight: 319.85222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18ClN3S/c1-4-5-6-13-10(2)19-20(11(13)3)16-18-14-8-7-12(17)9-15(14)21-16/h7-9H,4-6H2,1-3H3