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

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-2-[[5-methyl-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-2-[[5-methyl-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(2-methyl-5-nitrophenyl)-2-[[5-methyl-4-(2-oxolanylmethyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-2-[[5-methyl-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(2-methyl-5-nitro-phenyl)-2-[[5-methyl-4-(tetrahydrofurfuryl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C18H23N5O4S MolecularWeight: 405.47132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C)SC2=NN=C(N2CC3CCCO3)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C)SC2=NN=C(N2CC3CCCO3)C

InChI

InChI=1S/C18H23N5O4S/c1-11-6-7-14(23(25)26)9-16(11)19-17(24)12(2)28-18-21-20-13(3)22(18)10-15-5-4-8-27-15/h6-7,9,12,15H,4-5,8,10H2,1-3H3,(H,19,24)