2-[[5-(benzotriazol-1-ylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-[2,4-bis(fluoranyl)phenyl]ethanamide

Systemtic Name: 2-[[5-(benzotriazol-1-ylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-[2,4-bis(fluoranyl)phenyl]ethanamide Openeye Name: 2-[[4-allyl-5-(benzotriazol-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4-difluorophenyl)acetamide CAS Name: 2-[[5-(1-benzotriazolylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-N-(2,4-difluorophenyl)acetamide IUPAC Name: 2-[[5-(benzotriazol-1-ylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4-difluorophenyl)acetamide Traditional Name: 2-[[4-allyl-5-(benzotriazol-1-ylmethyl)-1,2,4-triazol-3-yl]thio]-N-(2,4-difluorophenyl)acetamide Formula: C20H17F2N7OS MolecularWeight: 441.457086

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)F)F)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)F)F)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H17F2N7OS/c1-2-9-28-18(11-29-17-6-4-3-5-16(17)24-27-29)25-26-20(28)31-12-19(30)23-15-8-7-13(21)10-14(15)22/h2-8,10H,1,9,11-12H2,(H,23,30)