N-(4-methylphenyl)-4-[(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)methyl]-1,3-thiazol-2-amine

Systemtic Name: N-(4-methylphenyl)-4-[(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)methyl]-1,3-thiazol-2-amine Openeye Name: 4-[(4-morpholinosulfonyl-2-nitro-phenoxy)methyl]-N-(p-tolyl)thiazol-2-amine CAS Name: N-(4-methylphenyl)-4-[[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]methyl]-2-thiazolamine IUPAC Name: N-(4-methylphenyl)-4-[(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)methyl]-1,3-thiazol-2-amine Traditional Name: [4-[(4-morpholinosulfonyl-2-nitro-phenoxy)methyl]thiazol-2-yl]-(p-tolyl)amine Formula: C21H22N4O6S2 MolecularWeight: 490.55258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=CS2)COC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=CS2)COC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O6S2/c1-15-2-4-16(5-3-15)22-21-23-17(14-32-21)13-31-20-7-6-18(12-19(20)25(26)27)33(28,29)24-8-10-30-11-9-24/h2-7,12,14H,8-11,13H2,1H3,(H,22,23)