4-(4-methoxyphenyl)sulfonyl-N-(phenylmethyl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-methoxyphenyl)sulfonyl-N-(phenylmethyl)piperazine-1-carbothioamide Openeye Name: N-benzyl-4-(4-methoxyphenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: 4-(4-methoxyphenyl)sulfonyl-N-(phenylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-benzyl-4-(4-methoxyphenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-benzyl-4-(4-methoxyphenyl)sulfonyl-piperazine-1-carbothioamide Formula: C19H23N3O3S2 MolecularWeight: 405.53422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C19H23N3O3S2/c1-25-17-7-9-18(10-8-17)27(23,24)22-13-11-21(12-14-22)19(26)20-15-16-5-3-2-4-6-16/h2-10H,11-15H2,1H3,(H,20,26)