1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methanone

Systemtic Name: 1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methanone Openeye Name: [1-benzyl-3-(2-thienyl)pyrazol-4-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone CAS Name: 1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]methanone IUPAC Name: (1-benzyl-3-thiophen-2-ylpyrazol-4-yl)-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone Traditional Name: [1-benzyl-3-(2-thienyl)pyrazol-4-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12OCCO2)C(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC12OCCO2)C(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C22H23N3O3S/c26-21(24-10-8-22(9-11-24)27-12-13-28-22)18-16-25(15-17-5-2-1-3-6-17)23-20(18)19-7-4-14-29-19/h1-7,14,16H,8-13,15H2