N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-nitro-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-nitro-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-nitro-N-(2-pyridylmethyl)benzamide CAS Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-nitro-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-nitro-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-nitro-N-(2-pyridylmethyl)benzamide Formula: C22H18N4O4S MolecularWeight: 434.46772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)OC)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=C(C=C1)OC)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O4S/c1-14-9-10-18(30-2)19-20(14)31-22(24-19)25(13-16-7-3-4-11-23-16)21(27)15-6-5-8-17(12-15)26(28)29/h3-12H,13H2,1-2H3