[4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(2-chloranyl-3-nitro-phenyl)methanone

Systemtic Name: [4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(2-chloranyl-3-nitro-phenyl)methanone Openeye Name: [4-(4-tert-butylthiazol-2-yl)-1-piperidyl]-(2-chloro-3-nitro-phenyl)methanone CAS Name: [4-(4-tert-butyl-2-thiazolyl)-1-piperidinyl]-(2-chloro-3-nitrophenyl)methanone IUPAC Name: [4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(2-chloro-3-nitrophenyl)methanone Traditional Name: [4-(4-tert-butylthiazol-2-yl)piperidino]-(2-chloro-3-nitro-phenyl)methanone Formula: C19H22ClN3O3S MolecularWeight: 407.91428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=C(C(=CC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=C(C(=CC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H22ClN3O3S/c1-19(2,3)15-11-27-17(21-15)12-7-9-22(10-8-12)18(24)13-5-4-6-14(16(13)20)23(25)26/h4-6,11-12H,7-10H2,1-3H3