N-(2-methylphenyl)-3-oxidanylidene-2-(phenylmethyl)-4-oxa-2,8-diazaspiro[4.5]decane-8-carbothioamide

Systemtic Name: N-(2-methylphenyl)-3-oxidanylidene-2-(phenylmethyl)-4-oxa-2,8-diazaspiro[4.5]decane-8-carbothioamide Openeye Name: 2-benzyl-N-(o-tolyl)-3-oxo-4-oxa-2,8-diazaspiro[4.5]decane-8-carbothioamide CAS Name: N-(2-methylphenyl)-3-oxo-2-(phenylmethyl)-4-oxa-2,8-diazaspiro[4.5]decane-8-carbothioamide IUPAC Name: 2-benzyl-N-(2-methylphenyl)-3-oxo-4-oxa-2,8-diazaspiro[4.5]decane-8-carbothioamide Traditional Name: 2-benzyl-3-keto-N-(o-tolyl)-4-oxa-2,8-diazaspiro[4.5]decane-8-carbothioamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N2CCC3(CC2)CN(C(=O)O3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N2CCC3(CC2)CN(C(=O)O3)CC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O2S/c1-17-7-5-6-10-19(17)23-20(28)24-13-11-22(12-14-24)16-25(21(26)27-22)15-18-8-3-2-4-9-18/h2-10H,11-16H2,1H3,(H,23,28)