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

Systemtic Name: 8-methoxy-3-(pyridin-3-ylmethylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole Openeye Name: 8-methoxy-3-(3-pyridylmethylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole CAS Name: 8-methoxy-3-(3-pyridinylmethylthio)-5H-[1,2,4]triazino[5,6-b]indole IUPAC Name: 8-methoxy-3-(pyridin-3-ylmethylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole Traditional Name: 8-methoxy-3-(3-pyridylmethylthio)-5H-[1,2,4]triazin[5,6-b]indole Formula: C16H13N5OS MolecularWeight: 323.37232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC3=C2N=NC(=N3)SCC4=CN=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)NC3=C2N=NC(=N3)SCC4=CN=CC=C4

InChI

InChI=1S/C16H13N5OS/c1-22-11-4-5-13-12(7-11)14-15(18-13)19-16(21-20-14)23-9-10-3-2-6-17-8-10/h2-8H,9H2,1H3,(H,18,19,21)