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

Systemtic Name: 3-[[5-[(4-phenoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]butan-2-one Openeye Name: 3-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]butan-2-one CAS Name: 3-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]thio]-2-butanone IUPAC Name: 3-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]butan-2-one Traditional Name: 3-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]thio]butan-2-one Formula: C18H17N3O2S2 MolecularWeight: 371.47648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)SC1=NN=C(S1)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)C)SC1=NN=C(S1)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C18H17N3O2S2/c1-12(22)13(2)24-18-21-20-17(25-18)19-14-8-10-16(11-9-14)23-15-6-4-3-5-7-15/h3-11,13H,1-2H3,(H,19,20)