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

Systemtic Name: N-(1-adamantyl)-1-(2-methylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: N-(1-adamantyl)-1-(2-methylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: N-(1-adamantyl)-1-[(2-methylphenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: N-(1-adamantyl)-1-(2-methylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: N-(1-adamantyl)-1-o-toluoyl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Formula: C26H35N3O2S MolecularWeight: 453.64

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCSC23CCN(CC3)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCSC23CCN(CC3)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H35N3O2S/c1-18-4-2-3-5-22(18)23(30)29-10-11-32-26(29)6-8-28(9-7-26)24(31)27-25-15-19-12-20(16-25)14-21(13-19)17-25/h2-5,19-21H,6-17H2,1H3,(H,27,31)