2-[(1-oxidanylidene-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)sulfonyl]benzenecarbonitrile

Systemtic Name: 2-[(1-oxidanylidene-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)sulfonyl]benzenecarbonitrile Openeye Name: 2-[(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)sulfonyl]benzonitrile CAS Name: 2-[(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)sulfonyl]benzonitrile IUPAC Name: 2-[(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)sulfonyl]benzonitrile Traditional Name: 2-[(1-keto-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)sulfonyl]benzonitrile Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C20H20N4O3S/c21-14-16-6-4-5-9-18(16)28(26,27)23-12-10-20(11-13-23)19(25)22-15-24(20)17-7-2-1-3-8-17/h1-9H,10-13,15H2,(H,22,25)