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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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