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

Systemtic Name: [2-[(2E)-2-hydroxyimino-2-(4-methylphenyl)ethyl]sulfonylethanoylamino]carbamodithioic acid Openeye Name: [[2-[(2E)-2-hydroxyimino-2-(p-tolyl)ethyl]sulfonylacetyl]amino]carbamodithioic acid CAS Name: [[2-[(2E)-2-hydroxyimino-2-(4-methylphenyl)ethyl]sulfonyl-1-oxoethyl]amino]carbamodithioic acid IUPAC Name: [[2-[(2E)-2-hydroxyimino-2-(4-methylphenyl)ethyl]sulfonylacetyl]amino]carbamodithioic acid Traditional Name: [[2-[(2E)-2-hydroximino-2-(p-tolyl)ethyl]sulfonylacetyl]amino]carbamodithioic acid Formula: C12H15N3O4S3 MolecularWeight: 361.4602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=NO)CS(=O)(=O)CC(=O)NNC(=S)S

Isomeric SMILES

CC1=CC=C(C=C1)/C(=N\O)/CS(=O)(=O)CC(=O)NNC(=S)S

InChI

InChI=1S/C12H15N3O4S3/c1-8-2-4-9(5-3-8)10(15-17)6-22(18,19)7-11(16)13-14-12(20)21/h2-5,17H,6-7H2,1H3,(H,13,16)(H2,14,20,21)/b15-10-