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

Systemtic Name: 8-propan-2-yl-3-(pyridin-3-ylmethylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole Openeye Name: 8-isopropyl-3-(3-pyridylmethylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole CAS Name: 8-propan-2-yl-3-(3-pyridinylmethylthio)-5H-[1,2,4]triazino[5,6-b]indole IUPAC Name: 8-propan-2-yl-3-(pyridin-3-ylmethylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole Traditional Name: 8-isopropyl-3-(3-pyridylmethylthio)-5H-[1,2,4]triazin[5,6-b]indole Formula: C18H17N5S MolecularWeight: 335.42608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N5S/c1-11(2)13-5-6-15-14(8-13)16-17(20-15)21-18(23-22-16)24-10-12-4-3-7-19-9-12/h3-9,11H,10H2,1-2H3,(H,20,21,23)