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

Systemtic Name: 3-(6-methylheptan-2-yl)-N-(4-morpholin-4-ylsulfonylphenyl)-4-(3-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: 3-(1,5-dimethylhexyl)-N-(4-morpholinosulfonylphenyl)-4-(3-nitrophenyl)thiazol-2-imine CAS Name: 3-(6-methylheptan-2-yl)-N-[4-(4-morpholinylsulfonyl)phenyl]-4-(3-nitrophenyl)-2-thiazolimine IUPAC Name: 3-(6-methylheptan-2-yl)-N-(4-morpholin-4-ylsulfonylphenyl)-4-(3-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: [3-(1,5-dimethylhexyl)-4-(3-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(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C27H34N4O5S2/c1-20(2)6-4-7-21(3)30-26(22-8-5-9-24(18-22)31(32)33)19-37-27(30)28-23-10-12-25(13-11-23)38(34,35)29-14-16-36-17-15-29/h5,8-13,18-21H,4,6-7,14-17H2,1-3H3