N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-(2-methoxyethylamino)-5-nitro-benzamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-(2-methoxyethylamino)-5-nitro-benzamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-(2-methoxyethylamino)-5-nitro-benzamide CAS Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-(2-methoxyethylamino)-5-nitrobenzamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-(2-methoxyethylamino)-5-nitrobenzamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-(2-methoxyethylamino)-5-nitro-benzamide Formula: C24H22N4O4S MolecularWeight: 462.52088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H22N4O4S/c1-32-13-12-25-20-11-10-18(28(30)31)15-19(20)24(29)26-17-8-6-16(7-9-17)14-23-27-21-4-2-3-5-22(21)33-23/h2-11,15,25H,12-14H2,1H3,(H,26,29)