dimethylcarbamodithioic acid; (phenylmethyl) carbamimidothioate

Systemtic Name: dimethylcarbamodithioic acid; (phenylmethyl) carbamimidothioate Openeye Name: 2-benzylisothiourea; dimethylcarbamodithioic acid CAS Name: carbamimidothioic acid (phenylmethyl) ester; dimethylcarbamodithioic acid IUPAC Name: benzyl carbamimidothioate; dimethylcarbamodithioic acid Traditional Name: 2-benzylisothiourea; dimethylcarbamodithioic acid Formula: C11H17N3S3 MolecularWeight: 287.46778

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)S.C1=CC=C(C=C1)CSC(=N)N

Isomeric SMILES

CN(C)C(=S)S.C1=CC=C(C=C1)CSC(=N)N

InChI

InChI=1S/C8H10N2S.C3H7NS2/c9-8(10)11-6-7-4-2-1-3-5-7;1-4(2)3(5)6/h1-5H,6H2,(H3,9,10);1-2H3,(H,5,6)