N-butyl-4-(4-butylphenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-butyl-4-(4-butylphenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-butyl-4-(4-butylphenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-butyl-4-(4-butylphenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-butyl-4-(4-butylphenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-butyl-4-(4-butylphenyl)sulfonyl-piperazine-1-carbothioamide Formula: C19H31N3O2S2 MolecularWeight: 397.59834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCCCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCCCC

InChI

InChI=1S/C19H31N3O2S2/c1-3-5-7-17-8-10-18(11-9-17)26(23,24)22-15-13-21(14-16-22)19(25)20-12-6-4-2/h8-11H,3-7,12-16H2,1-2H3,(H,20,25)