N-(1,3-benzodioxol-5-ylmethyl)-8-(2-methylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-8-(2-methylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-8-(2-methylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-8-[(2-methylphenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-8-(2-methylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Traditional Name: 8-o-toluoyl-N-piperonyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCC3(CC2)NC(CS3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCC3(CC2)NC(CS3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H27N3O4S/c1-16-4-2-3-5-18(16)23(29)27-10-8-24(9-11-27)26-19(14-32-24)22(28)25-13-17-6-7-20-21(12-17)31-15-30-20/h2-7,12,19,26H,8-11,13-15H2,1H3,(H,25,28)