N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-benzamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]-4-[(4-methyl-2-thiazolyl)thio]-3-nitrobenzamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitrobenzamide Traditional Name: N-[4-(4-ethylpiperazino)-2-methyl-phenyl]-4-[(4-methylthiazol-2-yl)thio]-3-nitro-benzamide Formula: C24H27N5O3S2 MolecularWeight: 497.63288

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC(=C(C=C3)SC4=NC(=CS4)C)[N+](=O)[O-])C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC(=C(C=C3)SC4=NC(=CS4)C)[N+](=O)[O-])C

InChI

InChI=1S/C24H27N5O3S2/c1-4-27-9-11-28(12-10-27)19-6-7-20(16(2)13-19)26-23(30)18-5-8-22(21(14-18)29(31)32)34-24-25-17(3)15-33-24/h5-8,13-15H,4,9-12H2,1-3H3,(H,26,30)