[2-[(2E)-2-(4-chlorophenyl)-2-hydroxyimino-ethyl]sulfonylethanoylamino]carbamodithioic acid

Systemtic Name: [2-[(2E)-2-(4-chlorophenyl)-2-hydroxyimino-ethyl]sulfonylethanoylamino]carbamodithioic acid Openeye Name: [[2-[(2E)-2-(4-chlorophenyl)-2-hydroxyimino-ethyl]sulfonylacetyl]amino]carbamodithioic acid CAS Name: [[2-[(2E)-2-(4-chlorophenyl)-2-hydroxyiminoethyl]sulfonyl-1-oxoethyl]amino]carbamodithioic acid IUPAC Name: [[2-[(2E)-2-(4-chlorophenyl)-2-hydroxyiminoethyl]sulfonylacetyl]amino]carbamodithioic acid Traditional Name: [[2-[(2E)-2-(4-chlorophenyl)-2-hydroximino-ethyl]sulfonylacetyl]amino]carbamodithioic acid Formula: C11H12ClN3O4S3 MolecularWeight: 381.87868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=NO)CS(=O)(=O)CC(=O)NNC(=S)S)Cl

Isomeric SMILES

C1=CC(=CC=C1/C(=N\O)/CS(=O)(=O)CC(=O)NNC(=S)S)Cl

InChI

InChI=1S/C11H12ClN3O4S3/c12-8-3-1-7(2-4-8)9(15-17)5-22(18,19)6-10(16)13-14-11(20)21/h1-4,17H,5-6H2,(H,13,16)(H2,14,20,21)/b15-9-