N-(1,3-benzothiazol-2-ylmethyl)-1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-fluorophenyl)-5-(2-thienyl)-1,2,4-triazole-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-fluorophenyl)-5-(2-thienyl)-1,2,4-triazole-3-carboxamide Formula: C21H14FN5OS2 MolecularWeight: 435.497163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CNC(=O)C3=NN(C(=N3)C4=CC=CS4)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CNC(=O)C3=NN(C(=N3)C4=CC=CS4)C5=CC=C(C=C5)F

InChI

InChI=1S/C21H14FN5OS2/c22-13-7-9-14(10-8-13)27-20(17-6-3-11-29-17)25-19(26-27)21(28)23-12-18-24-15-4-1-2-5-16(15)30-18/h1-11H,12H2,(H,23,28)