N-(4-ethanoylphenyl)-4-naphthalen-2-ylsulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-(4-ethanoylphenyl)-4-naphthalen-2-ylsulfonyl-piperazine-1-carbothioamide Openeye Name: N-(4-acetylphenyl)-4-(2-naphthylsulfonyl)piperazine-1-carbothioamide CAS Name: N-(4-acetylphenyl)-4-(2-naphthalenylsulfonyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-acetylphenyl)-4-naphthalen-2-ylsulfonylpiperazine-1-carbothioamide Traditional Name: N-(4-acetylphenyl)-4-(2-naphthylsulfonyl)piperazine-1-carbothioamide Formula: C23H23N3O3S2 MolecularWeight: 453.57702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O3S2/c1-17(27)18-6-9-21(10-7-18)24-23(30)25-12-14-26(15-13-25)31(28,29)22-11-8-19-4-2-3-5-20(19)16-22/h2-11,16H,12-15H2,1H3,(H,24,30)