2-[3-(2-azanylethyl)-1H-indol-5-yl]ethanethioamide

Systemtic Name: 2-[3-(2-azanylethyl)-1H-indol-5-yl]ethanethioamide Openeye Name: 2-[3-(2-aminoethyl)-1H-indol-5-yl]thioacetamide CAS Name: 2-[3-(2-aminoethyl)-1H-indol-5-yl]ethanethioamide IUPAC Name: 2-[3-(2-aminoethyl)-1H-indol-5-yl]ethanethioamide Traditional Name: 2-[3-(2-aminoethyl)-1H-indol-5-yl]thioacetamide Formula: C12H15N3S MolecularWeight: 233.3326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CC(=S)N)C(=CN2)CCN

Isomeric SMILES

C1=CC2=C(C=C1CC(=S)N)C(=CN2)CCN

InChI

InChI=1S/C12H15N3S/c13-4-3-9-7-15-11-2-1-8(5-10(9)11)6-12(14)16/h1-2,5,7,15H,3-4,6,13H2,(H2,14,16)