N-(4-methoxyphenyl)-2-methyl-3-oxidanylidene-4-(phenylmethyl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide

Systemtic Name: N-(4-methoxyphenyl)-2-methyl-3-oxidanylidene-4-(phenylmethyl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Openeye Name: 4-benzyl-N-(4-methoxyphenyl)-2-methyl-3-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide CAS Name: N-(4-methoxyphenyl)-2-methyl-3-oxo-4-(phenylmethyl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide IUPAC Name: 4-benzyl-N-(4-methoxyphenyl)-2-methyl-3-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Traditional Name: 4-benzyl-3-keto-N-(4-methoxyphenyl)-2-methyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2(N1)CCN(CC2)C(=S)NC3=CC=C(C=C3)OC)CC4=CC=CC=C4

Isomeric SMILES

CC1C(=O)N(C2(N1)CCN(CC2)C(=S)NC3=CC=C(C=C3)OC)CC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O2S/c1-17-21(28)27(16-18-6-4-3-5-7-18)23(25-17)12-14-26(15-13-23)22(30)24-19-8-10-20(29-2)11-9-19/h3-11,17,25H,12-16H2,1-2H3,(H,24,30)