5-chloranyl-N-(6-ethyl-1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-(6-ethyl-1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-(6-ethyl-1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-(6-ethyl-1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)-3-methyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-(6-ethyl-1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)-3-methylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-(6-ethyl-1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide Formula: C20H16ClFN4OS MolecularWeight: 414.883643

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(N(N=C3C)C4=CC=C(C=C4)F)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(N(N=C3C)C4=CC=C(C=C4)F)Cl

InChI

InChI=1S/C20H16ClFN4OS/c1-3-12-4-9-15-16(10-12)28-20(23-15)24-19(27)17-11(2)25-26(18(17)21)14-7-5-13(22)6-8-14/h4-10H,3H2,1-2H3,(H,23,24,27)