N-cyclohexyl-2-(3,4-dimethylphenyl)-3-methylsulfanyl-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide

Systemtic Name: N-cyclohexyl-2-(3,4-dimethylphenyl)-3-methylsulfanyl-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide Openeye Name: N-cyclohexyl-2-(3,4-dimethylphenyl)-3-methylsulfanyl-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide CAS Name: N-cyclohexyl-2-(3,4-dimethylphenyl)-3-(methylthio)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide IUPAC Name: N-cyclohexyl-2-(3,4-dimethylphenyl)-3-methylsulfanyl-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide Traditional Name: N-cyclohexyl-2-(3,4-dimethylphenyl)-3-(methylthio)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide Formula: C23H32N4OS MolecularWeight: 412.59138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3(CCN(CC3)C(=O)NC4CCCCC4)N=C2SC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3(CCN(CC3)C(=O)NC4CCCCC4)N=C2SC)C

InChI

InChI=1S/C23H32N4OS/c1-16-9-10-18(15-17(16)2)20-21(29-3)26-23(25-20)11-13-27(14-12-23)22(28)24-19-7-5-4-6-8-19/h9-10,15,19H,4-8,11-14H2,1-3H3,(H,24,28)