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

Systemtic Name: 4-[[5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-phenyl-butan-1-one Openeye Name: 4-[[5-(3-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-phenyl-butan-1-one CAS Name: 4-[[5-(3-methoxyanilino)-1,3,4-thiadiazol-2-yl]thio]-1-phenyl-1-butanone IUPAC Name: 4-[[5-(3-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-phenylbutan-1-one Traditional Name: 4-[[5-(m-anisidino)-1,3,4-thiadiazol-2-yl]thio]-1-phenyl-butan-1-one Formula: C19H19N3O2S2 MolecularWeight: 385.50306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O2S2/c1-24-16-10-5-9-15(13-16)20-18-21-22-19(26-18)25-12-6-11-17(23)14-7-3-2-4-8-14/h2-5,7-10,13H,6,11-12H2,1H3,(H,20,21)