N-[2-(1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2-chloranyl-ethanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2-chloranyl-ethanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2-chloro-acetamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolyl]-2-chloroacetamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]-2-chloroacetamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2-chloro-acetamide Formula: C13H11ClN4OS MolecularWeight: 306.77064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CCl)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CCl)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H11ClN4OS/c1-8-6-11(16-12(19)7-14)18(17-8)13-15-9-4-2-3-5-10(9)20-13/h2-6H,7H2,1H3,(H,16,19)