[4-(6-nitropyridin-3-yl)piperazin-1-yl]-[2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methanone

Systemtic Name: [4-(6-nitropyridin-3-yl)piperazin-1-yl]-[2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methanone Openeye Name: [2-(4-isopropylphenyl)thiazol-4-yl]-[4-(6-nitro-3-pyridyl)piperazin-1-yl]methanone CAS Name: [4-(6-nitro-3-pyridinyl)-1-piperazinyl]-[2-(4-propan-2-ylphenyl)-4-thiazolyl]methanone IUPAC Name: [4-(6-nitropyridin-3-yl)piperazin-1-yl]-[2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methanone Traditional Name: [4-(6-nitro-3-pyridyl)piperazino]-(2-p-cumenylthiazol-4-yl)methanone Formula: C22H23N5O3S MolecularWeight: 437.51472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N5O3S/c1-15(2)16-3-5-17(6-4-16)21-24-19(14-31-21)22(28)26-11-9-25(10-12-26)18-7-8-20(23-13-18)27(29)30/h3-8,13-15H,9-12H2,1-2H3