N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]-3-nitro-benzamide

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C3=CSC(=N3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C3=CSC(=N3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H12N4O3S/c23-17(11-4-3-5-12(8-11)22(24)25)21-18-20-16(10-26-18)14-9-19-15-7-2-1-6-13(14)15/h1-10,19H,(H,20,21,23)