N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-nitro-4-[(phenylmethyl)amino]benzamide

Systemtic Name: N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-nitro-4-[(phenylmethyl)amino]benzamide Openeye Name: 4-(benzylamino)-N-[4-(4-methoxyphenyl)thiazol-2-yl]-3-nitro-benzamide CAS Name: N-[4-(4-methoxyphenyl)-2-thiazolyl]-3-nitro-4-[(phenylmethyl)amino]benzamide IUPAC Name: 4-(benzylamino)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-nitrobenzamide Traditional Name: 4-(benzylamino)-N-[4-(4-methoxyphenyl)thiazol-2-yl]-3-nitro-benzamide Formula: C24H20N4O4S MolecularWeight: 460.505

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)NCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)NCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H20N4O4S/c1-32-19-10-7-17(8-11-19)21-15-33-24(26-21)27-23(29)18-9-12-20(22(13-18)28(30)31)25-14-16-5-3-2-4-6-16/h2-13,15,25H,14H2,1H3,(H,26,27,29)