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

Systemtic Name: [4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(3-methoxy-2-nitro-phenyl)methanone Openeye Name: [4-(4-tert-butylthiazol-2-yl)-1-piperidyl]-(3-methoxy-2-nitro-phenyl)methanone CAS Name: [4-(4-tert-butyl-2-thiazolyl)-1-piperidinyl]-(3-methoxy-2-nitrophenyl)methanone IUPAC Name: [4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(3-methoxy-2-nitrophenyl)methanone Traditional Name: [4-(4-tert-butylthiazol-2-yl)piperidino]-(3-methoxy-2-nitro-phenyl)methanone Formula: C20H25N3O4S MolecularWeight: 403.4952

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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)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O4S/c1-20(2,3)16-12-28-18(21-16)13-8-10-22(11-9-13)19(24)14-6-5-7-15(27-4)17(14)23(25)26/h5-7,12-13H,8-11H2,1-4H3