2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3-ethanoylphenyl)propanamide

Systemtic Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3-ethanoylphenyl)propanamide Openeye Name: N-(3-acetylphenyl)-2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide CAS Name: N-(3-acetylphenyl)-2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]thio]propanamide IUPAC Name: N-(3-acetylphenyl)-2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide Traditional Name: N-(3-acetylphenyl)-2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]thio]propionamide Formula: C17H22N4O2S2 MolecularWeight: 378.51218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NN=C(S1)SC(C)C(=O)NC2=CC=CC(=C2)C(=O)C

Isomeric SMILES

CCCCNC1=NN=C(S1)SC(C)C(=O)NC2=CC=CC(=C2)C(=O)C

InChI

InChI=1S/C17H22N4O2S2/c1-4-5-9-18-16-20-21-17(25-16)24-12(3)15(23)19-14-8-6-7-13(10-14)11(2)22/h6-8,10,12H,4-5,9H2,1-3H3,(H,18,20)(H,19,23)