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

Systemtic Name: N-[4-[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]phenyl]-3-nitro-benzamide Openeye Name: N-[4-[2-(4-methylanilino)thiazol-4-yl]phenyl]-3-nitro-benzamide CAS Name: N-[4-[2-(4-methylanilino)-4-thiazolyl]phenyl]-3-nitrobenzamide IUPAC Name: N-[4-[2-(4-methylanilino)-1,3-thiazol-4-yl]phenyl]-3-nitrobenzamide Traditional Name: 3-nitro-N-[4-[2-(p-toluidino)thiazol-4-yl]phenyl]benzamide Formula: C23H18N4O3S MolecularWeight: 430.47902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=CS2)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=CS2)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H18N4O3S/c1-15-5-9-19(10-6-15)25-23-26-21(14-31-23)16-7-11-18(12-8-16)24-22(28)17-3-2-4-20(13-17)27(29)30/h2-14H,1H3,(H,24,28)(H,25,26)