3-(6-methylheptan-2-yl)-N-(2-nitrophenyl)-4-thiophen-2-yl-1,3-thiazol-2-imine

Systemtic Name: 3-(6-methylheptan-2-yl)-N-(2-nitrophenyl)-4-thiophen-2-yl-1,3-thiazol-2-imine Openeye Name: 3-(1,5-dimethylhexyl)-N-(2-nitrophenyl)-4-(2-thienyl)thiazol-2-imine CAS Name: 3-(6-methylheptan-2-yl)-N-(2-nitrophenyl)-4-thiophen-2-yl-2-thiazolimine IUPAC Name: 3-(6-methylheptan-2-yl)-N-(2-nitrophenyl)-4-thiophen-2-yl-1,3-thiazol-2-imine Traditional Name: [3-(1,5-dimethylhexyl)-4-(2-thienyl)-4-thiazolin-2-ylidene]-(2-nitrophenyl)amine Formula: C21H25N3O2S2 MolecularWeight: 415.5721

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)N1C(=CSC1=NC2=CC=CC=C2[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

CC(C)CCCC(C)N1C(=CSC1=NC2=CC=CC=C2[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C21H25N3O2S2/c1-15(2)8-6-9-16(3)23-19(20-12-7-13-27-20)14-28-21(23)22-17-10-4-5-11-18(17)24(25)26/h4-5,7,10-16H,6,8-9H2,1-3H3