N-[3-[3-cyclopropyl-5-(3-oxidanylpropylsulfanyl)-1,2,4-triazol-4-yl]phenyl]ethanamide

Systemtic Name: N-[3-[3-cyclopropyl-5-(3-oxidanylpropylsulfanyl)-1,2,4-triazol-4-yl]phenyl]ethanamide Openeye Name: N-[3-[3-cyclopropyl-5-(3-hydroxypropylsulfanyl)-1,2,4-triazol-4-yl]phenyl]acetamide CAS Name: N-[3-[3-cyclopropyl-5-(3-hydroxypropylthio)-1,2,4-triazol-4-yl]phenyl]acetamide IUPAC Name: N-[3-[3-cyclopropyl-5-(3-hydroxypropylsulfanyl)-1,2,4-triazol-4-yl]phenyl]acetamide Traditional Name: N-[3-[3-cyclopropyl-5-(3-hydroxypropylthio)-1,2,4-triazol-4-yl]phenyl]acetamide Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)N2C(=NN=C2SCCCO)C3CC3

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)N2C(=NN=C2SCCCO)C3CC3

InChI

InChI=1S/C16H20N4O2S/c1-11(22)17-13-4-2-5-14(10-13)20-15(12-6-7-12)18-19-16(20)23-9-3-8-21/h2,4-5,10,12,21H,3,6-9H2,1H3,(H,17,22)