N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-2-(2-methoxyethylamino)-5-nitro-benzamide

Systemtic Name: N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-2-(2-methoxyethylamino)-5-nitro-benzamide Openeye Name: N-[4-[4-(acetamidomethyl)phenyl]thiazol-2-yl]-2-(2-methoxyethylamino)-5-nitro-benzamide CAS Name: N-[4-[4-(acetamidomethyl)phenyl]-2-thiazolyl]-2-(2-methoxyethylamino)-5-nitrobenzamide IUPAC Name: N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-2-(2-methoxyethylamino)-5-nitrobenzamide Traditional Name: N-[4-[4-(acetamidomethyl)phenyl]thiazol-2-yl]-2-(2-methoxyethylamino)-5-nitro-benzamide Formula: C22H23N5O5S MolecularWeight: 469.51352

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NCCOC

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NCCOC

InChI

InChI=1S/C22H23N5O5S/c1-14(28)24-12-15-3-5-16(6-4-15)20-13-33-22(25-20)26-21(29)18-11-17(27(30)31)7-8-19(18)23-9-10-32-2/h3-8,11,13,23H,9-10,12H2,1-2H3,(H,24,28)(H,25,26,29)