[3-(1H-indol-3-yl)propanoylamino]carbamodithioic acid

Systemtic Name: [3-(1H-indol-3-yl)propanoylamino]carbamodithioic acid Openeye Name: [3-(1H-indol-3-yl)propanoylamino]carbamodithioic acid CAS Name: [[3-(1H-indol-3-yl)-1-oxopropyl]amino]carbamodithioic acid IUPAC Name: [3-(1H-indol-3-yl)propanoylamino]carbamodithioic acid Traditional Name: [3-(1H-indol-3-yl)propanoylamino]carbamodithioic acid Formula: C12H13N3OS2 MolecularWeight: 279.38112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCC(=O)NNC(=S)S

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCC(=O)NNC(=S)S

InChI

InChI=1S/C12H13N3OS2/c16-11(14-15-12(17)18)6-5-8-7-13-10-4-2-1-3-9(8)10/h1-4,7,13H,5-6H2,(H,14,16)(H2,15,17,18)