[2-[[1,3-benzodioxol-5-ylmethyl-[(4-tert-butylphenyl)methyl]amino]methyl]-1,3-thiazol-4-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone

Systemtic Name: [2-[[1,3-benzodioxol-5-ylmethyl-[(4-tert-butylphenyl)methyl]amino]methyl]-1,3-thiazol-4-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone Openeye Name: [2-[[1,3-benzodioxol-5-ylmethyl-[(4-tert-butylphenyl)methyl]amino]methyl]thiazol-4-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone CAS Name: [2-[[1,3-benzodioxol-5-ylmethyl-[(4-tert-butylphenyl)methyl]amino]methyl]-4-thiazolyl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone IUPAC Name: [2-[[1,3-benzodioxol-5-ylmethyl-[(4-tert-butylphenyl)methyl]amino]methyl]-1,3-thiazol-4-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone Traditional Name: [2-[[(4-tert-butylbenzyl)-piperonyl-amino]methyl]thiazol-4-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone Formula: C31H37N3O5S MolecularWeight: 563.70758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC3=C(C=C2)OCO3)CC4=NC(=CS4)C(=O)N5CCC6(CC5)OCCO6

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC3=C(C=C2)OCO3)CC4=NC(=CS4)C(=O)N5CCC6(CC5)OCCO6

InChI

InChI=1S/C31H37N3O5S/c1-30(2,3)24-7-4-22(5-8-24)17-33(18-23-6-9-26-27(16-23)37-21-36-26)19-28-32-25(20-40-28)29(35)34-12-10-31(11-13-34)38-14-15-39-31/h4-9,16,20H,10-15,17-19,21H2,1-3H3