N-(3-methylsulfanylpropyl)-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-methylsulfanylpropyl)-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine-1-carbothioamide Openeye Name: N-(3-methylsulfanylpropyl)-4-tetralin-6-ylsulfonyl-piperazine-1-carbothioamide CAS Name: N-[3-(methylthio)propyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-methylsulfanylpropyl)-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine-1-carbothioamide Traditional Name: N-[3-(methylthio)propyl]-4-tetralin-6-ylsulfonyl-piperazine-1-carbothioamide Formula: C19H29N3O2S3 MolecularWeight: 427.64746

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC3=C(CCCC3)C=C2

Isomeric SMILES

CSCCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC3=C(CCCC3)C=C2

InChI

InChI=1S/C19H29N3O2S3/c1-26-14-4-9-20-19(25)21-10-12-22(13-11-21)27(23,24)18-8-7-16-5-2-3-6-17(16)15-18/h7-8,15H,2-6,9-14H2,1H3,(H,20,25)