N-[4-(2-methoxy-5-methyl-phenyl)-1,3-thiazol-2-yl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[4-(2-methoxy-5-methyl-phenyl)-1,3-thiazol-2-yl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide Openeye Name: N-[4-(2-methoxy-5-methyl-phenyl)thiazol-2-yl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide CAS Name: N-[4-(2-methoxy-5-methylphenyl)-2-thiazolyl]-4-(4-methyl-1-piperazinyl)-3-nitrobenzamide IUPAC Name: N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]-4-(4-methylpiperazin-1-yl)-3-nitrobenzamide Traditional Name: N-[4-(2-methoxy-5-methyl-phenyl)thiazol-2-yl]-4-(4-methylpiperazino)-3-nitro-benzamide Formula: C23H25N5O4S MolecularWeight: 467.5407

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)N4CCN(CC4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)N4CCN(CC4)C)[N+](=O)[O-]

InChI

InChI=1S/C23H25N5O4S/c1-15-4-7-21(32-3)17(12-15)18-14-33-23(24-18)25-22(29)16-5-6-19(20(13-16)28(30)31)27-10-8-26(2)9-11-27/h4-7,12-14H,8-11H2,1-3H3,(H,24,25,29)