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

Systemtic Name: N-ethyl-4-(3-methoxypropyl)-3-oxidanylidene-2-(phenylmethyl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Openeye Name: 2-benzyl-N-ethyl-4-(3-methoxypropyl)-3-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide CAS Name: N-ethyl-4-(3-methoxypropyl)-3-oxo-2-(phenylmethyl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide IUPAC Name: 2-benzyl-N-ethyl-4-(3-methoxypropyl)-3-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Traditional Name: 2-benzyl-N-ethyl-3-keto-4-(3-methoxypropyl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Formula: C21H32N4O2S MolecularWeight: 404.56938

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CCC2(CC1)NC(C(=O)N2CCCOC)CC3=CC=CC=C3

Isomeric SMILES

CCNC(=S)N1CCC2(CC1)NC(C(=O)N2CCCOC)CC3=CC=CC=C3

InChI

InChI=1S/C21H32N4O2S/c1-3-22-20(28)24-13-10-21(11-14-24)23-18(16-17-8-5-4-6-9-17)19(26)25(21)12-7-15-27-2/h4-6,8-9,18,23H,3,7,10-16H2,1-2H3,(H,22,28)