6-[4-(4-methylpiperazin-1-yl)phenyl]carbonyl-N-(4-methylsulfanylphenyl)-6-azaspiro[2.5]octane-2-carboxamide

Systemtic Name: 6-[4-(4-methylpiperazin-1-yl)phenyl]carbonyl-N-(4-methylsulfanylphenyl)-6-azaspiro[2.5]octane-2-carboxamide Openeye Name: 6-[4-(4-methylpiperazin-1-yl)benzoyl]-N-(4-methylsulfanylphenyl)-6-azaspiro[2.5]octane-2-carboxamide CAS Name: 6-[[4-(4-methyl-1-piperazinyl)phenyl]-oxomethyl]-N-[4-(methylthio)phenyl]-6-azaspiro[2.5]octane-2-carboxamide IUPAC Name: 6-[4-(4-methylpiperazin-1-yl)benzoyl]-N-(4-methylsulfanylphenyl)-6-azaspiro[2.5]octane-2-carboxamide Traditional Name: 6-[4-(4-methylpiperazino)benzoyl]-N-[4-(methylthio)phenyl]-6-azaspiro[2.5]octane-2-carboxamide Formula: C27H34N4O2S MolecularWeight: 478.64946

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)C(=O)N3CCC4(CC3)CC4C(=O)NC5=CC=C(C=C5)SC

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)C(=O)N3CCC4(CC3)CC4C(=O)NC5=CC=C(C=C5)SC

InChI

InChI=1S/C27H34N4O2S/c1-29-15-17-30(18-16-29)22-7-3-20(4-8-22)26(33)31-13-11-27(12-14-31)19-24(27)25(32)28-21-5-9-23(34-2)10-6-21/h3-10,24H,11-19H2,1-2H3,(H,28,32)