[1-(3-fluoranyl-4-morpholin-4-yl-phenyl)-1,2,3-triazol-4-yl]methylcarbamodithioic acid

Systemtic Name: [1-(3-fluoranyl-4-morpholin-4-yl-phenyl)-1,2,3-triazol-4-yl]methylcarbamodithioic acid Openeye Name: [1-(3-fluoro-4-morpholino-phenyl)triazol-4-yl]methylcarbamodithioic acid CAS Name: [1-[3-fluoro-4-(4-morpholinyl)phenyl]-4-triazolyl]methylcarbamodithioic acid IUPAC Name: [1-(3-fluoro-4-morpholin-4-ylphenyl)triazol-4-yl]methylcarbamodithioic acid Traditional Name: [1-(3-fluoro-4-morpholino-phenyl)triazol-4-yl]methylcarbamodithioic acid Formula: C14H16FN5OS2 MolecularWeight: 353.438143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)N3C=C(N=N3)CNC(=S)S)F

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)N3C=C(N=N3)CNC(=S)S)F

InChI

InChI=1S/C14H16FN5OS2/c15-12-7-11(1-2-13(12)19-3-5-21-6-4-19)20-9-10(17-18-20)8-16-14(22)23/h1-2,7,9H,3-6,8H2,(H2,16,22,23)