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

Systemtic Name: N,N-bis(2-cyanoethyl)-2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethanamide Openeye Name: N,N-bis(2-cyanoethyl)-2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide CAS Name: N,N-bis(2-cyanoethyl)-2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)thio]acetamide IUPAC Name: N,N-bis(2-cyanoethyl)-2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide Traditional Name: N,N-bis(2-cyanoethyl)-2-[(5-ethyl-[1,2,4]triazin[5,6-b]indol-3-yl)thio]acetamide Formula: C19H19N7OS MolecularWeight: 393.46546

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)N(CCC#N)CCC#N

Isomeric SMILES

CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C19H19N7OS/c1-2-26-15-8-4-3-7-14(15)17-18(26)22-19(24-23-17)28-13-16(27)25(11-5-9-20)12-6-10-21/h3-4,7-8H,2,5-6,11-13H2,1H3