N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-4-phenoxy-butanamide

Systemtic Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-4-phenoxy-butanamide Openeye Name: 4-phenoxy-N-(5-sec-butylsulfanyl-1,3,4-thiadiazol-2-yl)butanamide CAS Name: N-[5-(butan-2-ylthio)-1,3,4-thiadiazol-2-yl]-4-phenoxybutanamide IUPAC Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-4-phenoxybutanamide Traditional Name: 4-phenoxy-N-[5-(sec-butylthio)-1,3,4-thiadiazol-2-yl]butyramide Formula: C16H21N3O2S2 MolecularWeight: 351.48684

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NN=C(S1)NC(=O)CCCOC2=CC=CC=C2

Isomeric SMILES

CCC(C)SC1=NN=C(S1)NC(=O)CCCOC2=CC=CC=C2

InChI

InChI=1S/C16H21N3O2S2/c1-3-12(2)22-16-19-18-15(23-16)17-14(20)10-7-11-21-13-8-5-4-6-9-13/h4-6,8-9,12H,3,7,10-11H2,1-2H3,(H,17,18,20)