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

Systemtic Name: 3-nitro-N-[3-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)phenyl]benzamide Openeye Name: 3-nitro-N-[3-(2-pyrrolidin-1-ylthiazol-4-yl)phenyl]benzamide CAS Name: 3-nitro-N-[3-[2-(1-pyrrolidinyl)-4-thiazolyl]phenyl]benzamide IUPAC Name: 3-nitro-N-[3-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)phenyl]benzamide Traditional Name: 3-nitro-N-[3-(2-pyrrolidinothiazol-4-yl)phenyl]benzamide Formula: C20H18N4O3S MolecularWeight: 394.44692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=CS2)C3=CC(=CC=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=NC(=CS2)C3=CC(=CC=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O3S/c25-19(15-6-4-8-17(12-15)24(26)27)21-16-7-3-5-14(11-16)18-13-28-20(22-18)23-9-1-2-10-23/h3-8,11-13H,1-2,9-10H2,(H,21,25)