4-[[5-methyl-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxidanylidene-N-phenyl-butanamide

Systemtic Name: 4-[[5-methyl-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxidanylidene-N-phenyl-butanamide Openeye Name: 4-[[5-methyl-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxo-N-phenyl-butanamide CAS Name: 4-[[5-methyl-4-(2-oxolanylmethyl)-1,2,4-triazol-3-yl]thio]-3-oxo-N-phenylbutanamide IUPAC Name: 4-[[5-methyl-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxo-N-phenylbutanamide Traditional Name: 3-keto-4-[[5-methyl-4-(tetrahydrofurfuryl)-1,2,4-triazol-3-yl]thio]-N-phenyl-butyramide Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC2CCCO2)SCC(=O)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=NN=C(N1CC2CCCO2)SCC(=O)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C18H22N4O3S/c1-13-20-21-18(22(13)11-16-8-5-9-25-16)26-12-15(23)10-17(24)19-14-6-3-2-4-7-14/h2-4,6-7,16H,5,8-12H2,1H3,(H,19,24)