4-bromanyl-N-[4-(4-hydroxyphenyl)carbonyl-9-pyrrolidin-1-yl-4-azaspiro[4.5]decan-8-yl]-N-methyl-benzenecarbothioamide

Systemtic Name: 4-bromanyl-N-[4-(4-hydroxyphenyl)carbonyl-9-pyrrolidin-1-yl-4-azaspiro[4.5]decan-8-yl]-N-methyl-benzenecarbothioamide Openeye Name: 4-bromo-N-[4-(4-hydroxybenzoyl)-9-pyrrolidin-1-yl-4-azaspiro[4.5]decan-8-yl]-N-methyl-benzenecarbothioamide CAS Name: 4-bromo-N-[4-[(4-hydroxyphenyl)-oxomethyl]-9-(1-pyrrolidinyl)-4-azaspiro[4.5]decan-8-yl]-N-methylbenzenecarbothioamide IUPAC Name: 4-bromo-N-[4-(4-hydroxybenzoyl)-9-pyrrolidin-1-yl-4-azaspiro[4.5]decan-8-yl]-N-methylbenzenecarbothioamide Traditional Name: 4-bromo-N-[4-(4-hydroxybenzoyl)-9-pyrrolidino-4-azaspiro[4.5]decan-8-yl]-N-methyl-thiobenzamide Formula: C28H34BrN3O2S MolecularWeight: 556.55746

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC2(CCCN2C(=O)C3=CC=C(C=C3)O)CC1N4CCCC4)C(=S)C5=CC=C(C=C5)Br

Isomeric SMILES

CN(C1CCC2(CCCN2C(=O)C3=CC=C(C=C3)O)CC1N4CCCC4)C(=S)C5=CC=C(C=C5)Br

InChI

InChI=1S/C28H34BrN3O2S/c1-30(27(35)21-5-9-22(29)10-6-21)24-13-15-28(19-25(24)31-16-2-3-17-31)14-4-18-32(28)26(34)20-7-11-23(33)12-8-20/h5-12,24-25,33H,2-4,13-19H2,1H3