N-[2-(4-methoxyphenyl)ethyl]-4-methylsulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-4-methylsulfonyl-piperazine-1-carbothioamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]-4-methylsulfonyl-piperazine-1-carbothioamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-4-methylsulfonyl-1-piperazinecarbothioamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]-4-methylsulfonylpiperazine-1-carbothioamide Traditional Name: 4-mesyl-N-[2-(4-methoxyphenyl)ethyl]piperazine-1-carbothioamide Formula: C15H23N3O3S2 MolecularWeight: 357.49142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=S)N2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=S)N2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C15H23N3O3S2/c1-21-14-5-3-13(4-6-14)7-8-16-15(22)17-9-11-18(12-10-17)23(2,19)20/h3-6H,7-12H2,1-2H3,(H,16,22)