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

Systemtic Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [2-(4-ethylphenyl)thiazol-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [2-(4-ethylphenyl)-4-thiazolyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [2-(4-ethylphenyl)thiazol-4-yl]-[4-(4-nitrophenyl)piperazino]methanone Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O3S/c1-2-16-3-5-17(6-4-16)21-23-20(15-30-21)22(27)25-13-11-24(12-14-25)18-7-9-19(10-8-18)26(28)29/h3-10,15H,2,11-14H2,1H3