(7S)-8-oxidanylidene-10-(4-phenylpiperazin-1-yl)-9,11-diazaspiro[5.5]undec-10-ene-7-carbonitrile

Systemtic Name: (7S)-8-oxidanylidene-10-(4-phenylpiperazin-1-yl)-9,11-diazaspiro[5.5]undec-10-ene-7-carbonitrile Openeye Name: (7S)-8-oxo-10-(4-phenylpiperazin-1-yl)-9,11-diazaspiro[5.5]undec-10-ene-7-carbonitrile CAS Name: (7S)-8-oxo-10-(4-phenyl-1-piperazinyl)-9,11-diazaspiro[5.5]undec-10-ene-7-carbonitrile IUPAC Name: (7S)-8-oxo-10-(4-phenylpiperazin-1-yl)-9,11-diazaspiro[5.5]undec-10-ene-7-carbonitrile Traditional Name: (7S)-8-keto-10-(4-phenylpiperazino)-9,11-diazaspiro[5.5]undec-10-ene-7-carbonitrile Formula: C20H25N5O MolecularWeight: 351.4454

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C(C(=O)NC(=N2)N3CCN(CC3)C4=CC=CC=C4)C#N

Isomeric SMILES

C1CCC2(CC1)[C@H](C(=O)NC(=N2)N3CCN(CC3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C20H25N5O/c21-15-17-18(26)22-19(23-20(17)9-5-2-6-10-20)25-13-11-24(12-14-25)16-7-3-1-4-8-16/h1,3-4,7-8,17H,2,5-6,9-14H2,(H,22,23,26)/t17-/m0/s1