8-ethoxy-5-methyl-3-(pyridin-3-ylmethylsulfanyl)-[1,2,4]triazino[5,6-b]indole

Systemtic Name: 8-ethoxy-5-methyl-3-(pyridin-3-ylmethylsulfanyl)-[1,2,4]triazino[5,6-b]indole Openeye Name: 8-ethoxy-5-methyl-3-(3-pyridylmethylsulfanyl)-[1,2,4]triazino[5,6-b]indole CAS Name: 8-ethoxy-5-methyl-3-(3-pyridinylmethylthio)-[1,2,4]triazino[5,6-b]indole IUPAC Name: 8-ethoxy-5-methyl-3-(pyridin-3-ylmethylsulfanyl)-[1,2,4]triazino[5,6-b]indole Traditional Name: 8-ethoxy-5-methyl-3-(3-pyridylmethylthio)-[1,2,4]triazin[5,6-b]indole Formula: C18H17N5OS MolecularWeight: 351.42548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C3=C2N=NC(=N3)SCC4=CN=CC=C4)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C3=C2N=NC(=N3)SCC4=CN=CC=C4)C

InChI

InChI=1S/C18H17N5OS/c1-3-24-13-6-7-15-14(9-13)16-17(23(15)2)20-18(22-21-16)25-11-12-5-4-8-19-10-12/h4-10H,3,11H2,1-2H3