3-[5-[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[5-[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[2-(azepan-1-yl)-1-methyl-2-oxo-ethyl]sulfanyl-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[[1-(1-azepanyl)-1-oxopropan-2-yl]thio]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[1-(azepan-1-yl)-1-oxopropan-2-yl]sulfanyl-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[[2-(azepan-1-yl)-2-keto-1-methyl-ethyl]thio]-4-cyclopropyl-1,2,4-triazol-3-yl]propionamide Formula: C17H27N5O2S MolecularWeight: 365.49358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)SC2=NN=C(N2C3CC3)CCC(=O)N

Isomeric SMILES

CC(C(=O)N1CCCCCC1)SC2=NN=C(N2C3CC3)CCC(=O)N

InChI

InChI=1S/C17H27N5O2S/c1-12(16(24)21-10-4-2-3-5-11-21)25-17-20-19-15(9-8-14(18)23)22(17)13-6-7-13/h12-13H,2-11H2,1H3,(H2,18,23)