[4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-[5-(2-nitrophenyl)furan-2-yl]methanone

Systemtic Name: [4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-[5-(2-nitrophenyl)furan-2-yl]methanone Openeye Name: [4-(4-tert-butylthiazol-2-yl)-1-piperidyl]-[5-(2-nitrophenyl)-2-furyl]methanone CAS Name: [4-(4-tert-butyl-2-thiazolyl)-1-piperidinyl]-[5-(2-nitrophenyl)-2-furanyl]methanone IUPAC Name: [4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-[5-(2-nitrophenyl)furan-2-yl]methanone Traditional Name: [4-(4-tert-butylthiazol-2-yl)piperidino]-[5-(2-nitrophenyl)-2-furyl]methanone Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C23H25N3O4S/c1-23(2,3)20-14-31-21(24-20)15-10-12-25(13-11-15)22(27)19-9-8-18(30-19)16-6-4-5-7-17(16)26(28)29/h4-9,14-15H,10-13H2,1-3H3