2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-ethylphenyl)propan-1-one

Systemtic Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-ethylphenyl)propan-1-one Openeye Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-ethylphenyl)propan-1-one CAS Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]thio]-1-(4-ethylphenyl)-1-propanone IUPAC Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-ethylphenyl)propan-1-one Traditional Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]thio]-1-(4-ethylphenyl)propan-1-one Formula: C17H23N3OS2 MolecularWeight: 349.51402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NN=C(S1)SC(C)C(=O)C2=CC=C(C=C2)CC

Isomeric SMILES

CCCCNC1=NN=C(S1)SC(C)C(=O)C2=CC=C(C=C2)CC

InChI

InChI=1S/C17H23N3OS2/c1-4-6-11-18-16-19-20-17(23-16)22-12(3)15(21)14-9-7-13(5-2)8-10-14/h7-10,12H,4-6,11H2,1-3H3,(H,18,19)