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

Systemtic Name: 2-ethylsulfanyl-9H-pyrimido[4,5-b]indole Openeye Name: 2-ethylsulfanyl-9H-pyrimido[4,5-b]indole CAS Name: 2-(ethylthio)-9H-pyrimido[4,5-b]indole IUPAC Name: 2-ethylsulfanyl-9H-pyrimido[4,5-b]indole Traditional Name: 2-(ethylthio)-9H-pyrimid[4,5-b]indole Formula: C12H11N3S MolecularWeight: 229.30084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11N3S/c1-2-16-12-13-7-9-8-5-3-4-6-10(8)14-11(9)15-12/h3-7H,2H2,1H3,(H,13,14,15)