1-(4-fluorophenyl)-4-[[5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]butan-1-one

Systemtic Name: 1-(4-fluorophenyl)-4-[[5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]butan-1-one Openeye Name: 1-(4-fluorophenyl)-4-[[5-(3-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]butan-1-one CAS Name: 1-(4-fluorophenyl)-4-[[5-(3-methoxyanilino)-1,3,4-thiadiazol-2-yl]thio]-1-butanone IUPAC Name: 1-(4-fluorophenyl)-4-[[5-(3-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]butan-1-one Traditional Name: 1-(4-fluorophenyl)-4-[[5-(m-anisidino)-1,3,4-thiadiazol-2-yl]thio]butan-1-one Formula: C19H18FN3O2S2 MolecularWeight: 403.493523

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NN=C(S2)SCCCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NN=C(S2)SCCCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H18FN3O2S2/c1-25-16-5-2-4-15(12-16)21-18-22-23-19(27-18)26-11-3-6-17(24)13-7-9-14(20)10-8-13/h2,4-5,7-10,12H,3,6,11H2,1H3,(H,21,22)