3-methylsulfanyl-6-phenyl-6,7-dihydro-5H-[1,2,4]triazino[5,6-d][1]benzazepine

Systemtic Name: 3-methylsulfanyl-6-phenyl-6,7-dihydro-5H-[1,2,4]triazino[5,6-d][1]benzazepine Openeye Name: 3-methylsulfanyl-6-phenyl-6,7-dihydro-5H-[1,2,4]triazino[5,6-d][1]benzazepine CAS Name: 3-(methylthio)-6-phenyl-6,7-dihydro-5H-[1,2,4]triazino[5,6-d][1]benzazepine IUPAC Name: 3-methylsulfanyl-6-phenyl-6,7-dihydro-5H-[1,2,4]triazino[5,6-d][1]benzazepine Traditional Name: 3-(methylthio)-6-phenyl-6,7-dihydro-5H-[1,2,4]triazino[5,6-d][1]benzazepine Formula: C18H16N4S MolecularWeight: 320.41144

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C3=CC=CC=C3NC(C2)C4=CC=CC=C4)N=N1

Isomeric SMILES

CSC1=NC2=C(C3=CC=CC=C3NC(C2)C4=CC=CC=C4)N=N1

InChI

InChI=1S/C18H16N4S/c1-23-18-20-16-11-15(12-7-3-2-4-8-12)19-14-10-6-5-9-13(14)17(16)21-22-18/h2-10,15,19H,11H2,1H3