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

Systemtic Name: N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-3-methyl-4-nitro-benzamide Openeye Name: N-[4-(4-cyanophenyl)thiazol-2-yl]-3-methyl-4-nitro-benzamide CAS Name: N-[4-(4-cyanophenyl)-2-thiazolyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-3-methyl-4-nitrobenzamide Traditional Name: N-[4-(4-cyanophenyl)thiazol-2-yl]-3-methyl-4-nitro-benzamide Formula: C18H12N4O3S MolecularWeight: 364.37788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12N4O3S/c1-11-8-14(6-7-16(11)22(24)25)17(23)21-18-20-15(10-26-18)13-4-2-12(9-19)3-5-13/h2-8,10H,1H3,(H,20,21,23)