3-heptan-4-yl-N-(2-methyl-4-nitro-phenyl)-4-(2-methylpropyl)-1,3-thiazolidin-2-imine

Systemtic Name: 3-heptan-4-yl-N-(2-methyl-4-nitro-phenyl)-4-(2-methylpropyl)-1,3-thiazolidin-2-imine Openeye Name: 4-isobutyl-N-(2-methyl-4-nitro-phenyl)-3-(1-propylbutyl)thiazolidin-2-imine CAS Name: 3-heptan-4-yl-N-(2-methyl-4-nitrophenyl)-4-(2-methylpropyl)-2-thiazolidinimine IUPAC Name: 3-heptan-4-yl-N-(2-methyl-4-nitrophenyl)-4-(2-methylpropyl)-1,3-thiazolidin-2-imine Traditional Name: [4-isobutyl-3-(1-propylbutyl)thiazolidin-2-ylidene]-(2-methyl-4-nitro-phenyl)amine Formula: C21H33N3O2S MolecularWeight: 391.57062

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)N1C(CSC1=NC2=C(C=C(C=C2)[N+](=O)[O-])C)CC(C)C

Isomeric SMILES

CCCC(CCC)N1C(CSC1=NC2=C(C=C(C=C2)[N+](=O)[O-])C)CC(C)C

InChI

InChI=1S/C21H33N3O2S/c1-6-8-17(9-7-2)23-19(12-15(3)4)14-27-21(23)22-20-11-10-18(24(25)26)13-16(20)5/h10-11,13,15,17,19H,6-9,12,14H2,1-5H3