N-[(4-methoxyphenyl)methyl]-4-naphthalen-2-ylsulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-4-naphthalen-2-ylsulfonyl-piperazine-1-carbothioamide Openeye Name: N-[(4-methoxyphenyl)methyl]-4-(2-naphthylsulfonyl)piperazine-1-carbothioamide CAS Name: N-[(4-methoxyphenyl)methyl]-4-(2-naphthalenylsulfonyl)-1-piperazinecarbothioamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-4-naphthalen-2-ylsulfonylpiperazine-1-carbothioamide Traditional Name: 4-(2-naphthylsulfonyl)-N-p-anisyl-piperazine-1-carbothioamide Formula: C23H25N3O3S2 MolecularWeight: 455.5929

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H25N3O3S2/c1-29-21-9-6-18(7-10-21)17-24-23(30)25-12-14-26(15-13-25)31(27,28)22-11-8-19-4-2-3-5-20(19)16-22/h2-11,16H,12-15,17H2,1H3,(H,24,30)