N-(3-ethanoylphenyl)-2-(2-methylpropyl)-3-oxidanylidene-4-prop-2-ynyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide

Systemtic Name: N-(3-ethanoylphenyl)-2-(2-methylpropyl)-3-oxidanylidene-4-prop-2-ynyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Openeye Name: N-(3-acetylphenyl)-2-isobutyl-3-oxo-4-prop-2-ynyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide CAS Name: N-(3-acetylphenyl)-2-(2-methylpropyl)-3-oxo-4-prop-2-ynyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide IUPAC Name: N-(3-acetylphenyl)-2-(2-methylpropyl)-3-oxo-4-prop-2-ynyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Traditional Name: N-(3-acetylphenyl)-2-isobutyl-3-keto-4-propargyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Formula: C23H30N4O2S MolecularWeight: 426.5749

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)N(C2(N1)CCN(CC2)C(=S)NC3=CC=CC(=C3)C(=O)C)CC#C

Isomeric SMILES

CC(C)CC1C(=O)N(C2(N1)CCN(CC2)C(=S)NC3=CC=CC(=C3)C(=O)C)CC#C

InChI

InChI=1S/C23H30N4O2S/c1-5-11-27-21(29)20(14-16(2)3)25-23(27)9-12-26(13-10-23)22(30)24-19-8-6-7-18(15-19)17(4)28/h1,6-8,15-16,20,25H,9-14H2,2-4H3,(H,24,30)