[4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(3-nitro-1H-pyrazol-5-yl)methanone

Systemtic Name: [4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(3-nitro-1H-pyrazol-5-yl)methanone Openeye Name: [4-(4-tert-butylthiazol-2-yl)-1-piperidyl]-(3-nitro-1H-pyrazol-5-yl)methanone CAS Name: [4-(4-tert-butyl-2-thiazolyl)-1-piperidinyl]-(3-nitro-1H-pyrazol-5-yl)methanone IUPAC Name: [4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(3-nitro-1H-pyrazol-5-yl)methanone Traditional Name: [4-(4-tert-butylthiazol-2-yl)piperidino]-(3-nitro-1H-pyrazol-5-yl)methanone Formula: C16H21N5O3S MolecularWeight: 363.43464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=CC(=NN3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=CC(=NN3)[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O3S/c1-16(2,3)12-9-25-14(17-12)10-4-6-20(7-5-10)15(22)11-8-13(19-18-11)21(23)24/h8-10H,4-7H2,1-3H3,(H,18,19)