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

Systemtic Name: 3-(phenylmethylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole Openeye Name: 3-benzylsulfanyl-5H-[1,2,4]triazino[5,6-b]indole CAS Name: 3-(phenylmethylthio)-5H-[1,2,4]triazino[5,6-b]indole IUPAC Name: 3-benzylsulfanyl-5H-[1,2,4]triazino[5,6-b]indole Traditional Name: 3-(benzylthio)-5H-[1,2,4]triazin[5,6-b]indole Formula: C16H12N4S MolecularWeight: 292.35828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC3=C(C4=CC=CC=C4N3)N=N2

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC3=C(C4=CC=CC=C4N3)N=N2

InChI

InChI=1S/C16H12N4S/c1-2-6-11(7-3-1)10-21-16-18-15-14(19-20-16)12-8-4-5-9-13(12)17-15/h1-9H,10H2,(H,17,18,20)