N-(3,5-dimethylphenyl)-3-(5-methyl-1-phenyl-pyrazol-4-yl)carbonyl-3,8-diazaspiro[4.5]decane-8-carbothioamide

Systemtic Name: N-(3,5-dimethylphenyl)-3-(5-methyl-1-phenyl-pyrazol-4-yl)carbonyl-3,8-diazaspiro[4.5]decane-8-carbothioamide Openeye Name: N-(3,5-dimethylphenyl)-3-(5-methyl-1-phenyl-pyrazole-4-carbonyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide CAS Name: N-(3,5-dimethylphenyl)-3-[(5-methyl-1-phenyl-4-pyrazolyl)-oxomethyl]-3,8-diazaspiro[4.5]decane-8-carbothioamide IUPAC Name: N-(3,5-dimethylphenyl)-3-(5-methyl-1-phenylpyrazole-4-carbonyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Traditional Name: N-(3,5-dimethylphenyl)-3-(5-methyl-1-phenyl-pyrazole-4-carbonyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Formula: C28H33N5OS MolecularWeight: 487.65952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N2CCC3(CC2)CCN(C3)C(=O)C4=C(N(N=C4)C5=CC=CC=C5)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N2CCC3(CC2)CCN(C3)C(=O)C4=C(N(N=C4)C5=CC=CC=C5)C)C

InChI

InChI=1S/C28H33N5OS/c1-20-15-21(2)17-23(16-20)30-27(35)31-12-9-28(10-13-31)11-14-32(19-28)26(34)25-18-29-33(22(25)3)24-7-5-4-6-8-24/h4-8,15-18H,9-14,19H2,1-3H3,(H,30,35)