2-methyl-N-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)-1,3-benzothiazol-6-amine

Systemtic Name: 2-methyl-N-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)-1,3-benzothiazol-6-amine Openeye Name: 2-methyl-N-(4-morpholinosulfonyl-2-nitro-phenyl)-1,3-benzothiazol-6-amine CAS Name: 2-methyl-N-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-1,3-benzothiazol-6-amine IUPAC Name: 2-methyl-N-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)-1,3-benzothiazol-6-amine Traditional Name: (2-methyl-1,3-benzothiazol-6-yl)-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C18H18N4O5S2 MolecularWeight: 434.48932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O5S2/c1-12-19-16-4-2-13(10-18(16)28-12)20-15-5-3-14(11-17(15)22(23)24)29(25,26)21-6-8-27-9-7-21/h2-5,10-11,20H,6-9H2,1H3