1-(2-methylphenyl)carbonyl-N-(4-methylsulfanylphenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide

Systemtic Name: 1-(2-methylphenyl)carbonyl-N-(4-methylsulfanylphenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: 1-(2-methylbenzoyl)-N-(4-methylsulfanylphenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: 1-[(2-methylphenyl)-oxomethyl]-N-[4-(methylthio)phenyl]-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: 1-(2-methylbenzoyl)-N-(4-methylsulfanylphenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: N-[4-(methylthio)phenyl]-1-o-toluoyl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Formula: C23H27N3O2S2 MolecularWeight: 441.60938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCSC23CCN(CC3)C(=O)NC4=CC=C(C=C4)SC

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCSC23CCN(CC3)C(=O)NC4=CC=C(C=C4)SC

InChI

InChI=1S/C23H27N3O2S2/c1-17-5-3-4-6-20(17)21(27)26-15-16-30-23(26)11-13-25(14-12-23)22(28)24-18-7-9-19(29-2)10-8-18/h3-10H,11-16H2,1-2H3,(H,24,28)