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

Systemtic Name: 2-(phenylmethylsulfanyl)-[1,2,4]triazino[5,6-b]indole Openeye Name: 2-benzylsulfanyl-[1,2,4]triazino[5,6-b]indole CAS Name: 2-(phenylmethylthio)-[1,2,4]triazino[5,6-b]indole IUPAC Name: 2-benzylsulfanyl-[1,2,4]triazino[5,6-b]indole Traditional Name: 2-(benzylthio)-[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)CSN2C=NC3=NC4=CC=CC=C4C3=N2

Isomeric SMILES

C1=CC=C(C=C1)CSN2C=NC3=NC4=CC=CC=C4C3=N2

InChI

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