[2-(4-ethylphenyl)-1,3-thiazol-4-yl]-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [2-(4-ethylphenyl)thiazol-4-yl]-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [2-(4-ethylphenyl)-4-thiazolyl]-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [2-(4-ethylphenyl)thiazol-4-yl]-[4-(3-nitrophenyl)sulfonylpiperazino]methanone Formula: C22H22N4O5S2 MolecularWeight: 486.56388

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O5S2/c1-2-16-6-8-17(9-7-16)21-23-20(15-32-21)22(27)24-10-12-25(13-11-24)33(30,31)19-5-3-4-18(14-19)26(28)29/h3-9,14-15H,2,10-13H2,1H3