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

Systemtic Name: N-[1-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[1-[4-(2-methylthiazol-4-yl)phenyl]ethyl]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[1-[4-(2-methyl-4-thiazolyl)phenyl]ethyl]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[1-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: 1-[4-(2-methylthiazol-4-yl)phenyl]ethyl-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C22H24N4O4S2 MolecularWeight: 472.58036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)C(C)NC3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)C(C)NC3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O4S2/c1-15(17-5-7-18(8-6-17)21-14-31-16(2)24-21)23-20-10-9-19(13-22(20)26(27)28)32(29,30)25-11-3-4-12-25/h5-10,13-15,23H,3-4,11-12H2,1-2H3