2-butan-2-ylsulfanyl-3-ethyl-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 2-butan-2-ylsulfanyl-3-ethyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-ethyl-2-sec-butylsulfanyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 2-(butan-2-ylthio)-3-ethyl-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 2-butan-2-ylsulfanyl-3-ethyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-ethyl-2-(sec-butylthio)-5H-pyrimid[5,4-b]indol-4-one Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NC2=C(C(=O)N1CC)NC3=CC=CC=C32

Isomeric SMILES

CCC(C)SC1=NC2=C(C(=O)N1CC)NC3=CC=CC=C32

InChI

InChI=1S/C16H19N3OS/c1-4-10(3)21-16-18-13-11-8-6-7-9-12(11)17-14(13)15(20)19(16)5-2/h6-10,17H,4-5H2,1-3H3