4-fluoranyl-N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]sulfanylcarbamoyl]benzamide

Systemtic Name: 4-fluoranyl-N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]sulfanylcarbamoyl]benzamide Openeye Name: 4-fluoro-N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]sulfanylcarbamoyl]benzamide CAS Name: 4-fluoro-N-[[[[2-(4-methoxyphenyl)-5-benzotriazolyl]thio]amino]-oxomethyl]benzamide IUPAC Name: 4-fluoro-N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]sulfanylcarbamoyl]benzamide Traditional Name: 4-fluoro-N-[[[2-(4-methoxyphenyl)benzotriazol-5-yl]thio]carbamoyl]benzamide Formula: C21H16FN5O3S MolecularWeight: 437.446843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)SNC(=O)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)SNC(=O)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FN5O3S/c1-30-16-8-6-15(7-9-16)27-24-18-11-10-17(12-19(18)25-27)31-26-21(29)23-20(28)13-2-4-14(22)5-3-13/h2-12H,1H3,(H2,23,26,28,29)