N-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decane-3-carbothioamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decane-3-carbothioamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-(2-thienylsulfonyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decane-3-carbothioamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decane-3-carbothioamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-(2-thienylsulfonyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Formula: C21H25N3O4S3 MolecularWeight: 479.6359

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12CCN(C2)C(=S)NC3=CC4=C(C=C3)OCCO4)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCC12CCN(C2)C(=S)NC3=CC4=C(C=C3)OCCO4)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C21H25N3O4S3/c25-31(26,19-2-1-13-30-19)24-9-6-21(7-10-24)5-8-23(15-21)20(29)22-16-3-4-17-18(14-16)28-12-11-27-17/h1-4,13-14H,5-12,15H2,(H,22,29)