4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-N-propyl-piperazine-1-carbothioamide

Systemtic Name: 4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-N-propyl-piperazine-1-carbothioamide Openeye Name: 4-indan-5-ylsulfonyl-N-propyl-piperazine-1-carbothioamide CAS Name: 4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-N-propyl-1-piperazinecarbothioamide IUPAC Name: 4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-N-propylpiperazine-1-carbothioamide Traditional Name: 4-indan-5-ylsulfonyl-N-propyl-piperazine-1-carbothioamide Formula: C17H25N3O2S2 MolecularWeight: 367.5293

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC3=C(CCC3)C=C2

Isomeric SMILES

CCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C17H25N3O2S2/c1-2-8-18-17(23)19-9-11-20(12-10-19)24(21,22)16-7-6-14-4-3-5-15(14)13-16/h6-7,13H,2-5,8-12H2,1H3,(H,18,23)