4-nitro-N-[5-(phenylmethyl)-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-nitro-N-[5-(phenylmethyl)-1,3-thiazol-2-yl]benzamide Openeye Name: N-(5-benzylthiazol-2-yl)-4-nitro-benzamide CAS Name: 4-nitro-N-[5-(phenylmethyl)-2-thiazolyl]benzamide IUPAC Name: N-(5-benzyl-1,3-thiazol-2-yl)-4-nitrobenzamide Traditional Name: N-(5-benzylthiazol-2-yl)-4-nitro-benzamide Formula: C17H13N3O3S MolecularWeight: 339.36842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O3S/c21-16(13-6-8-14(9-7-13)20(22)23)19-17-18-11-15(24-17)10-12-4-2-1-3-5-12/h1-9,11H,10H2,(H,18,19,21)