N-(4,5-dihydro-1,3-thiazol-2-yl)-2-[4-(methylamino)-3-nitro-phenyl]carbonyl-benzamide

Systemtic Name: N-(4,5-dihydro-1,3-thiazol-2-yl)-2-[4-(methylamino)-3-nitro-phenyl]carbonyl-benzamide Openeye Name: N-(4,5-dihydrothiazol-2-yl)-2-[4-(methylamino)-3-nitro-benzoyl]benzamide CAS Name: N-(4,5-dihydrothiazol-2-yl)-2-[[4-(methylamino)-3-nitrophenyl]-oxomethyl]benzamide IUPAC Name: N-(4,5-dihydro-1,3-thiazol-2-yl)-2-[4-(methylamino)-3-nitrobenzoyl]benzamide Traditional Name: 2-[4-(methylamino)-3-nitro-benzoyl]-N-(2-thiazolin-2-yl)benzamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NC3=NCCS3)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NC3=NCCS3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4S/c1-19-14-7-6-11(10-15(14)22(25)26)16(23)12-4-2-3-5-13(12)17(24)21-18-20-8-9-27-18/h2-7,10,19H,8-9H2,1H3,(H,20,21,24)