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

Systemtic Name: 3-(6-methylheptan-2-yl)-N-(4-morpholin-4-ylsulfonylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: 3-(1,5-dimethylhexyl)-N-(4-morpholinosulfonylphenyl)-4-(4-nitrophenyl)thiazol-2-imine CAS Name: 3-(6-methylheptan-2-yl)-N-[4-(4-morpholinylsulfonyl)phenyl]-4-(4-nitrophenyl)-2-thiazolimine IUPAC Name: 3-(6-methylheptan-2-yl)-N-(4-morpholin-4-ylsulfonylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: [3-(1,5-dimethylhexyl)-4-(4-nitrophenyl)-4-thiazolin-2-ylidene]-(4-morpholinosulfonylphenyl)amine Formula: C27H34N4O5S2 MolecularWeight: 558.71266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)N1C(=CSC1=NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCCC(C)N1C(=CSC1=NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H34N4O5S2/c1-20(2)5-4-6-21(3)30-26(22-7-11-24(12-8-22)31(32)33)19-37-27(30)28-23-9-13-25(14-10-23)38(34,35)29-15-17-36-18-16-29/h7-14,19-21H,4-6,15-18H2,1-3H3