N-(2-methyl-4-nitro-phenyl)-2-[4-(4-phenyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanamide

Systemtic Name: N-(2-methyl-4-nitro-phenyl)-2-[4-(4-phenyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanamide Openeye Name: N-(2-methyl-4-nitro-phenyl)-2-[4-(4-phenylthiazol-2-yl)piperazin-1-yl]acetamide CAS Name: N-(2-methyl-4-nitrophenyl)-2-[4-(4-phenyl-2-thiazolyl)-1-piperazinyl]acetamide IUPAC Name: N-(2-methyl-4-nitrophenyl)-2-[4-(4-phenyl-1,3-thiazol-2-yl)piperazin-1-yl]acetamide Traditional Name: N-(2-methyl-4-nitro-phenyl)-2-[4-(4-phenylthiazol-2-yl)piperazino]acetamide Formula: C22H23N5O3S MolecularWeight: 437.51472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CN2CCN(CC2)C3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CN2CCN(CC2)C3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N5O3S/c1-16-13-18(27(29)30)7-8-19(16)23-21(28)14-25-9-11-26(12-10-25)22-24-20(15-31-22)17-5-3-2-4-6-17/h2-8,13,15H,9-12,14H2,1H3,(H,23,28)