1-(4-ethylpiperazin-1-yl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one

Systemtic Name: 1-(4-ethylpiperazin-1-yl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Openeye Name: 1-(4-ethylpiperazin-1-yl)-2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one CAS Name: 1-(4-ethyl-1-piperazinyl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)thio]-1-propanone IUPAC Name: 1-(4-ethylpiperazin-1-yl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Traditional Name: 1-(4-ethylpiperazino)-2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)thio]propan-1-one Formula: C14H25N5OS MolecularWeight: 311.4462

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C(C)SC2=NNC(=N2)C(C)C

Isomeric SMILES

CCN1CCN(CC1)C(=O)C(C)SC2=NNC(=N2)C(C)C

InChI

InChI=1S/C14H25N5OS/c1-5-18-6-8-19(9-7-18)13(20)11(4)21-14-15-12(10(2)3)16-17-14/h10-11H,5-9H2,1-4H3,(H,15,16,17)