[5-(4-methylpiperazin-1-yl)carbonyl-2-phenyl-1,3-thiazol-4-yl]-(3-nitrophenyl)methanone

Systemtic Name: [5-(4-methylpiperazin-1-yl)carbonyl-2-phenyl-1,3-thiazol-4-yl]-(3-nitrophenyl)methanone Openeye Name: [5-(4-methylpiperazine-1-carbonyl)-2-phenyl-thiazol-4-yl]-(3-nitrophenyl)methanone CAS Name: [5-[(4-methyl-1-piperazinyl)-oxomethyl]-2-phenyl-4-thiazolyl]-(3-nitrophenyl)methanone IUPAC Name: [5-(4-methylpiperazine-1-carbonyl)-2-phenyl-1,3-thiazol-4-yl]-(3-nitrophenyl)methanone Traditional Name: [5-(4-methylpiperazine-1-carbonyl)-2-phenyl-thiazol-4-yl]-(3-nitrophenyl)methanone Formula: C22H20N4O4S MolecularWeight: 436.4836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=C(N=C(S2)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=C(N=C(S2)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O4S/c1-24-10-12-25(13-11-24)22(28)20-18(23-21(31-20)15-6-3-2-4-7-15)19(27)16-8-5-9-17(14-16)26(29)30/h2-9,14H,10-13H2,1H3