4-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-6-methoxy-2-methyl-quinoline

Systemtic Name: 4-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-6-methoxy-2-methyl-quinoline Openeye Name: 4-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-6-methoxy-2-methyl-quinoline CAS Name: 4-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-6-methoxy-2-methylquinoline IUPAC Name: 4-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-6-methoxy-2-methylquinoline Traditional Name: 4-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-6-methoxy-2-methyl-quinoline Formula: C20H17FN4OS MolecularWeight: 380.438583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)OC)C(=C1)SC3=NN=C(N3C)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)OC)C(=C1)SC3=NN=C(N3C)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H17FN4OS/c1-12-10-18(16-11-15(26-3)8-9-17(16)22-12)27-20-24-23-19(25(20)2)13-4-6-14(21)7-5-13/h4-11H,1-3H3