N-(2,6-dimethylphenyl)-4-(4-ethoxyphenyl)-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-1-imine

Systemtic Name: N-(2,6-dimethylphenyl)-4-(4-ethoxyphenyl)-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-1-imine Openeye Name: N-(2,6-dimethylphenyl)-4-(4-ethoxyphenyl)-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-1-imine CAS Name: N-(2,6-dimethylphenyl)-4-(4-ethoxyphenyl)-3-(methylthio)-2,4-diazaspiro[4.5]dec-2-en-1-imine IUPAC Name: N-(2,6-dimethylphenyl)-4-(4-ethoxyphenyl)-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-1-imine Traditional Name: (2,6-dimethylphenyl)-[3-(methylthio)-4-p-phenetyl-2,4-diazaspiro[4.5]dec-2-en-1-ylidene]amine Formula: C25H31N3OS MolecularWeight: 421.59814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NC(=NC3=C(C=CC=C3C)C)C24CCCCC4)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NC(=NC3=C(C=CC=C3C)C)C24CCCCC4)SC

InChI

InChI=1S/C25H31N3OS/c1-5-29-21-14-12-20(13-15-21)28-24(30-4)27-23(25(28)16-7-6-8-17-25)26-22-18(2)10-9-11-19(22)3/h9-15H,5-8,16-17H2,1-4H3