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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(CSC1=NC2=C(C=C(C=C2)[N+](=O)[O-])C)CC(C)C

Isomeric SMILES

CCCCCCCN1C(CSC1=NC2=C(C=C(C=C2)[N+](=O)[O-])C)CC(C)C

InChI

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