3-[(2-methyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-8-yl)carbonyl]benzenecarbonitrile

Systemtic Name: 3-[(2-methyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-8-yl)carbonyl]benzenecarbonitrile Openeye Name: 3-(2-methyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carbonyl)benzonitrile CAS Name: 3-[(2-methyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-8-yl)-oxomethyl]benzonitrile IUPAC Name: 3-(2-methyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carbonyl)benzonitrile Traditional Name: 3-(2-methyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carbonyl)benzonitrile Formula: C22H20N4O MolecularWeight: 356.4204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2(CCN(CC2)C(=O)C3=CC=CC(=C3)C#N)N=C1C4=CC=CC=C4

Isomeric SMILES

CC1=NC2(CCN(CC2)C(=O)C3=CC=CC(=C3)C#N)N=C1C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O/c1-16-20(18-7-3-2-4-8-18)25-22(24-16)10-12-26(13-11-22)21(27)19-9-5-6-17(14-19)15-23/h2-9,14H,10-13H2,1H3