4-cyano-N-methyl-N-(9-pyrrolidin-1-yl-4-oxaspiro[4.5]decan-8-yl)benzenecarbothioamide

Systemtic Name: 4-cyano-N-methyl-N-(9-pyrrolidin-1-yl-4-oxaspiro[4.5]decan-8-yl)benzenecarbothioamide Openeye Name: 4-cyano-N-methyl-N-(9-pyrrolidin-1-yl-4-oxaspiro[4.5]decan-8-yl)benzenecarbothioamide CAS Name: 4-cyano-N-methyl-N-[9-(1-pyrrolidinyl)-4-oxaspiro[4.5]decan-8-yl]benzenecarbothioamide IUPAC Name: 4-cyano-N-methyl-N-(9-pyrrolidin-1-yl-4-oxaspiro[4.5]decan-8-yl)benzenecarbothioamide Traditional Name: 4-cyano-N-methyl-N-(9-pyrrolidino-4-oxaspiro[4.5]decan-8-yl)thiobenzamide Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC2(CCCO2)CC1N3CCCC3)C(=S)C4=CC=C(C=C4)C#N

Isomeric SMILES

CN(C1CCC2(CCCO2)CC1N3CCCC3)C(=S)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H29N3OS/c1-24(21(27)18-7-5-17(16-23)6-8-18)19-9-11-22(10-4-14-26-22)15-20(19)25-12-2-3-13-25/h5-8,19-20H,2-4,9-15H2,1H3