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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-8-pentanoyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-8-pentanoyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-8-(1-oxopentyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-8-pentanoyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Traditional Name: N-piperonyl-8-valeryl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCC2(CC1)NC(CS2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCC(=O)N1CCC2(CC1)NC(CS2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H29N3O4S/c1-2-3-4-19(25)24-9-7-21(8-10-24)23-16(13-29-21)20(26)22-12-15-5-6-17-18(11-15)28-14-27-17/h5-6,11,16,23H,2-4,7-10,12-14H2,1H3,(H,22,26)