N-(2-dimethylaminoethyl)-4-(4-propylphenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-(4-propylphenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-(2-dimethylaminoethyl)-4-(4-propylphenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-(2-dimethylaminoethyl)-4-(4-propylphenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(2-dimethylaminoethyl)-4-(4-propylphenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-(2-dimethylaminoethyl)-4-(4-propylphenyl)sulfonyl-piperazine-1-carbothioamide Formula: C18H30N4O2S2 MolecularWeight: 398.5864

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCCN(C)C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCCN(C)C

InChI

InChI=1S/C18H30N4O2S2/c1-4-5-16-6-8-17(9-7-16)26(23,24)22-14-12-21(13-15-22)18(25)19-10-11-20(2)3/h6-9H,4-5,10-15H2,1-3H3,(H,19,25)