N-cyclohexyl-4-(4-ethoxyphenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-cyclohexyl-4-(4-ethoxyphenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-cyclohexyl-4-(4-ethoxyphenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-cyclohexyl-4-(4-ethoxyphenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-cyclohexyl-4-(4-ethoxyphenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-cyclohexyl-4-p-phenetylsulfonyl-piperazine-1-carbothioamide Formula: C19H29N3O3S2 MolecularWeight: 411.58186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NC3CCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NC3CCCCC3

InChI

InChI=1S/C19H29N3O3S2/c1-2-25-17-8-10-18(11-9-17)27(23,24)22-14-12-21(13-15-22)19(26)20-16-6-4-3-5-7-16/h8-11,16H,2-7,12-15H2,1H3,(H,20,26)