2-prop-2-enylsulfanyl-9H-pyrimido[4,5-b]indole

Systemtic Name: 2-prop-2-enylsulfanyl-9H-pyrimido[4,5-b]indole Openeye Name: 2-allylsulfanyl-9H-pyrimido[4,5-b]indole CAS Name: 2-(prop-2-enylthio)-9H-pyrimido[4,5-b]indole IUPAC Name: 2-prop-2-enylsulfanyl-9H-pyrimido[4,5-b]indole Traditional Name: 2-(allylthio)-9H-pyrimid[4,5-b]indole Formula: C13H11N3S MolecularWeight: 241.31154

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC=C2C3=CC=CC=C3NC2=N1

Isomeric SMILES

C=CCSC1=NC=C2C3=CC=CC=C3NC2=N1

InChI

InChI=1S/C13H11N3S/c1-2-7-17-13-14-8-10-9-5-3-4-6-11(9)15-12(10)16-13/h2-6,8H,1,7H2,(H,14,15,16)