N-(4-cyanophenyl)-1-(3-methylbutanoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide

Systemtic Name: N-(4-cyanophenyl)-1-(3-methylbutanoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: N-(4-cyanophenyl)-1-(3-methylbutanoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: N-(4-cyanophenyl)-1-(3-methyl-1-oxobutyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: N-(4-cyanophenyl)-1-(3-methylbutanoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: N-(4-cyanophenyl)-1-isovaleryl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCSC12CCN(CC2)C(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)CC(=O)N1CCSC12CCN(CC2)C(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H26N4O2S/c1-15(2)13-18(25)24-11-12-27-20(24)7-9-23(10-8-20)19(26)22-17-5-3-16(14-21)4-6-17/h3-6,15H,7-13H2,1-2H3,(H,22,26)