3-(5-methylhexan-2-yl)-N-(4-morpholin-4-ylsulfonylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine

Systemtic Name: 3-(5-methylhexan-2-yl)-N-(4-morpholin-4-ylsulfonylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: 3-(1,4-dimethylpentyl)-N-(4-morpholinosulfonylphenyl)-4-(4-nitrophenyl)thiazol-2-imine CAS Name: 3-(5-methylhexan-2-yl)-N-[4-(4-morpholinylsulfonyl)phenyl]-4-(4-nitrophenyl)-2-thiazolimine IUPAC Name: 3-(5-methylhexan-2-yl)-N-(4-morpholin-4-ylsulfonylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: [3-(1,4-dimethylpentyl)-4-(4-nitrophenyl)-4-thiazolin-2-ylidene]-(4-morpholinosulfonylphenyl)amine Formula: C26H32N4O5S2 MolecularWeight: 544.68608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32N4O5S2/c1-19(2)4-5-20(3)29-25(21-6-10-23(11-7-21)30(31)32)18-36-26(29)27-22-8-12-24(13-9-22)37(33,34)28-14-16-35-17-15-28/h6-13,18-20H,4-5,14-17H2,1-3H3