N-[(2-fluorophenyl)carbamoyl]-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(2-fluorophenyl)carbamoyl]-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-fluorophenyl)carbamoyl]acetamide CAS Name: N-[(2-fluoroanilino)-oxomethyl]-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(2-fluorophenyl)carbamoyl]-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)thio]-N-[(2-fluorophenyl)carbamoyl]acetamide Formula: C20H18FN5O2S MolecularWeight: 411.452623

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NC(=O)NC2=CC=CC=C2F)C3=CC=CC=C3

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NC(=O)NC2=CC=CC=C2F)C3=CC=CC=C3

InChI

InChI=1S/C20H18FN5O2S/c1-2-12-26-18(14-8-4-3-5-9-14)24-25-20(26)29-13-17(27)23-19(28)22-16-11-7-6-10-15(16)21/h2-11H,1,12-13H2,(H2,22,23,27,28)