2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(3-methylbutylcarbamoyl)ethanamide

Systemtic Name: 2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(3-methylbutylcarbamoyl)ethanamide Openeye Name: 2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(isopentylcarbamoyl)acetamide CAS Name: 2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)thio]-N-[(3-methylbutylamino)-oxomethyl]acetamide IUPAC Name: 2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(3-methylbutylcarbamoyl)acetamide Traditional Name: 2-[(5-ethyl-[1,2,4]triazin[5,6-b]indol-3-yl)thio]-N-(isoamylcarbamoyl)acetamide Formula: C19H24N6O2S MolecularWeight: 400.49786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NC(=O)NCCC(C)C

Isomeric SMILES

CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NC(=O)NCCC(C)C

InChI

InChI=1S/C19H24N6O2S/c1-4-25-14-8-6-5-7-13(14)16-17(25)22-19(24-23-16)28-11-15(26)21-18(27)20-10-9-12(2)3/h5-8,12H,4,9-11H2,1-3H3,(H2,20,21,26,27)