5-ethyl-3-(phenylmethylsulfanyl)-[1,2,4]triazino[5,6-b]indole

Systemtic Name: 5-ethyl-3-(phenylmethylsulfanyl)-[1,2,4]triazino[5,6-b]indole Openeye Name: 3-benzylsulfanyl-5-ethyl-[1,2,4]triazino[5,6-b]indole CAS Name: 5-ethyl-3-(phenylmethylthio)-[1,2,4]triazino[5,6-b]indole IUPAC Name: 3-benzylsulfanyl-5-ethyl-[1,2,4]triazino[5,6-b]indole Traditional Name: 3-(benzylthio)-5-ethyl-[1,2,4]triazin[5,6-b]indole Formula: C18H16N4S MolecularWeight: 320.41144

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC4=CC=CC=C4

Isomeric SMILES

CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC4=CC=CC=C4

InChI

InChI=1S/C18H16N4S/c1-2-22-15-11-7-6-10-14(15)16-17(22)19-18(21-20-16)23-12-13-8-4-3-5-9-13/h3-11H,2,12H2,1H3