N-[1-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-2-morpholin-4-ylsulfonyl-4-nitro-aniline

Systemtic Name: N-[1-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-2-morpholin-4-ylsulfonyl-4-nitro-aniline Openeye Name: N-[1-[4-(2-methylthiazol-4-yl)phenyl]ethyl]-2-morpholinosulfonyl-4-nitro-aniline CAS Name: N-[1-[4-(2-methyl-4-thiazolyl)phenyl]ethyl]-2-(4-morpholinylsulfonyl)-4-nitroaniline IUPAC Name: N-[1-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-2-morpholin-4-ylsulfonyl-4-nitroaniline Traditional Name: 1-[4-(2-methylthiazol-4-yl)phenyl]ethyl-(2-morpholinosulfonyl-4-nitro-phenyl)amine Formula: C22H24N4O5S2 MolecularWeight: 488.57976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)C(C)NC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)C(C)NC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H24N4O5S2/c1-15(17-3-5-18(6-4-17)21-14-32-16(2)24-21)23-20-8-7-19(26(27)28)13-22(20)33(29,30)25-9-11-31-12-10-25/h3-8,13-15,23H,9-12H2,1-2H3