sodium N-(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamodithioate

Systemtic Name: sodium N-(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamodithioate Openeye Name: sodium N-(3-ethoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamodithioate CAS Name: sodium N-(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamodithioate IUPAC Name: sodium N-(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamodithioate Traditional Name: sodium N-(3-carbethoxy-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamodithioate Formula: C12H14NNaO2S3 MolecularWeight: 323.42983

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)[S-].[Na+]

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)[S-].[Na+]

InChI

InChI=1S/C12H15NO2S3.Na/c1-2-15-11(14)9-7-5-3-4-6-8(7)18-10(9)13-12(16)17;/h2-6H2,1H3,(H2,13,16,17);/q;+1/p-1