N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methylsulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methylsulfonyl-piperazine-1-carbothioamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methylsulfonyl-piperazine-1-carbothioamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methylsulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methylsulfonylpiperazine-1-carbothioamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-mesyl-piperazine-1-carbothioamide Formula: C14H19N3O4S2 MolecularWeight: 357.44836

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=S)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=S)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C14H19N3O4S2/c1-23(18,19)17-6-4-16(5-7-17)14(22)15-11-2-3-12-13(10-11)21-9-8-20-12/h2-3,10H,4-9H2,1H3,(H,15,22)