4-[[4-(3,6-dimethylpyrazin-2-yl)piperazin-1-ium-1-yl]methyl]-5-methyl-2-(4-phenylphenyl)-1,3-oxazole

Systemtic Name: 4-[[4-(3,6-dimethylpyrazin-2-yl)piperazin-1-ium-1-yl]methyl]-5-methyl-2-(4-phenylphenyl)-1,3-oxazole Openeye Name: 4-[[4-(3,6-dimethylpyrazin-2-yl)piperazin-1-ium-1-yl]methyl]-5-methyl-2-(4-phenylphenyl)oxazole CAS Name: 4-[[4-(3,6-dimethyl-2-pyrazinyl)-1-piperazin-1-iumyl]methyl]-5-methyl-2-(4-phenylphenyl)oxazole IUPAC Name: 4-[[4-(3,6-dimethylpyrazin-2-yl)piperazin-1-ium-1-yl]methyl]-5-methyl-2-(4-phenylphenyl)-1,3-oxazole Traditional Name: 4-[[4-(3,6-dimethylpyrazin-2-yl)piperazin-1-ium-1-yl]methyl]-5-methyl-2-(4-phenylphenyl)oxazole Formula: C27H30N5O+ MolecularWeight: 440.56

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=N1)N2CC[NH+](CC2)CC3=C(OC(=N3)C4=CC=C(C=C4)C5=CC=CC=C5)C)C

Isomeric SMILES

CC1=CN=C(C(=N1)N2CC[NH+](CC2)CC3=C(OC(=N3)C4=CC=C(C=C4)C5=CC=CC=C5)C)C

InChI

InChI=1S/C27H29N5O/c1-19-17-28-20(2)26(29-19)32-15-13-31(14-16-32)18-25-21(3)33-27(30-25)24-11-9-23(10-12-24)22-7-5-4-6-8-22/h4-12,17H,13-16,18H2,1-3H3/p+1