5-phenethyl-3-prop-2-enylsulfanyl-[1,2,4]triazino[5,6-b]indole

Systemtic Name: 5-phenethyl-3-prop-2-enylsulfanyl-[1,2,4]triazino[5,6-b]indole Openeye Name: 3-allylsulfanyl-5-phenethyl-[1,2,4]triazino[5,6-b]indole CAS Name: 5-phenethyl-3-(prop-2-enylthio)-[1,2,4]triazino[5,6-b]indole IUPAC Name: 5-phenethyl-3-prop-2-enylsulfanyl-[1,2,4]triazino[5,6-b]indole Traditional Name: 3-(allylthio)-5-phenethyl-[1,2,4]triazin[5,6-b]indole Formula: C20H18N4S MolecularWeight: 346.44872

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC2=C(C3=CC=CC=C3N2CCC4=CC=CC=C4)N=N1

Isomeric SMILES

C=CCSC1=NC2=C(C3=CC=CC=C3N2CCC4=CC=CC=C4)N=N1

InChI

InChI=1S/C20H18N4S/c1-2-14-25-20-21-19-18(22-23-20)16-10-6-7-11-17(16)24(19)13-12-15-8-4-3-5-9-15/h2-11H,1,12-14H2