5-methyl-4-[2-[1-[(5-nitrothiophen-3-yl)methyl]piperidin-4-yl]-1,3-thiazol-4-yl]-3-phenyl-1,2-oxazole

Systemtic Name: 5-methyl-4-[2-[1-[(5-nitrothiophen-3-yl)methyl]piperidin-4-yl]-1,3-thiazol-4-yl]-3-phenyl-1,2-oxazole Openeye Name: 5-methyl-4-[2-[1-[(5-nitro-3-thienyl)methyl]-4-piperidyl]thiazol-4-yl]-3-phenyl-isoxazole CAS Name: 5-methyl-4-[2-[1-[(5-nitro-3-thiophenyl)methyl]-4-piperidinyl]-4-thiazolyl]-3-phenylisoxazole IUPAC Name: 5-methyl-4-[2-[1-[(5-nitrothiophen-3-yl)methyl]piperidin-4-yl]-1,3-thiazol-4-yl]-3-phenyl-1,2-oxazole Traditional Name: 5-methyl-4-[2-[1-[(5-nitro-3-thienyl)methyl]-4-piperidyl]thiazol-4-yl]-3-phenyl-isoxazole Formula: C23H22N4O3S2 MolecularWeight: 466.57578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C3=CSC(=N3)C4CCN(CC4)CC5=CSC(=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C3=CSC(=N3)C4CCN(CC4)CC5=CSC(=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H22N4O3S2/c1-15-21(22(25-30-15)17-5-3-2-4-6-17)19-14-32-23(24-19)18-7-9-26(10-8-18)12-16-11-20(27(28)29)31-13-16/h2-6,11,13-14,18H,7-10,12H2,1H3