2-butan-2-ylsulfanyl-3-(2-methoxyethyl)-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 2-butan-2-ylsulfanyl-3-(2-methoxyethyl)-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-(2-methoxyethyl)-2-sec-butylsulfanyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 2-(butan-2-ylthio)-3-(2-methoxyethyl)-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 2-butan-2-ylsulfanyl-3-(2-methoxyethyl)-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-(2-methoxyethyl)-2-(sec-butylthio)-5H-pyrimid[5,4-b]indol-4-one Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NC2=C(C(=O)N1CCOC)NC3=CC=CC=C32

Isomeric SMILES

CCC(C)SC1=NC2=C(C(=O)N1CCOC)NC3=CC=CC=C32

InChI

InChI=1S/C17H21N3O2S/c1-4-11(2)23-17-19-14-12-7-5-6-8-13(12)18-15(14)16(21)20(17)9-10-22-3/h5-8,11,18H,4,9-10H2,1-3H3