4-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-2-oxo-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile CAS Name: 4-[4-(diphenylmethyl)-1-piperazinyl]-2-oxo-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-2-oxo-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile Traditional Name: 4-(4-benzhydrylpiperazino)-2-keto-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile Formula: C28H33N5O MolecularWeight: 455.59452

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2(CC1)C(C(=O)NC(=N2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

C1CCCC2(CC1)C(C(=O)NC(=N2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C28H33N5O/c29-21-24-26(34)30-27(31-28(24)15-9-1-2-10-16-28)33-19-17-32(18-20-33)25(22-11-5-3-6-12-22)23-13-7-4-8-14-23/h3-8,11-14,24-25H,1-2,9-10,15-20H2,(H,30,31,34)