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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-8-(4-ethylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-8-(4-ethylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-8-[(4-ethylphenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-8-(4-ethylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Traditional Name: 8-(4-ethylbenzoyl)-N-piperonyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Formula: C25H29N3O4S MolecularWeight: 467.58046

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCC3(CC2)NC(CS3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCC3(CC2)NC(CS3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H29N3O4S/c1-2-17-3-6-19(7-4-17)24(30)28-11-9-25(10-12-28)27-20(15-33-25)23(29)26-14-18-5-8-21-22(13-18)32-16-31-21/h3-8,13,20,27H,2,9-12,14-16H2,1H3,(H,26,29)