8-methyl-3-phenethylsulfanyl-5-propyl-[1,2,4]triazino[5,6-b]indole

Systemtic Name: 8-methyl-3-phenethylsulfanyl-5-propyl-[1,2,4]triazino[5,6-b]indole Openeye Name: 8-methyl-3-phenethylsulfanyl-5-propyl-[1,2,4]triazino[5,6-b]indole CAS Name: 8-methyl-3-(phenethylthio)-5-propyl-[1,2,4]triazino[5,6-b]indole IUPAC Name: 8-methyl-3-phenethylsulfanyl-5-propyl-[1,2,4]triazino[5,6-b]indole Traditional Name: 8-methyl-3-(phenethylthio)-5-propyl-[1,2,4]triazin[5,6-b]indole Formula: C21H22N4S MolecularWeight: 362.49118

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)C)C3=C1N=C(N=N3)SCCC4=CC=CC=C4

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)C)C3=C1N=C(N=N3)SCCC4=CC=CC=C4

InChI

InChI=1S/C21H22N4S/c1-3-12-25-18-10-9-15(2)14-17(18)19-20(25)22-21(24-23-19)26-13-11-16-7-5-4-6-8-16/h4-10,14H,3,11-13H2,1-2H3