2-propan-2-ylsulfanyl-3-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 2-propan-2-ylsulfanyl-3-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-allyl-2-isopropylsulfanyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 2-(propan-2-ylthio)-3-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 2-propan-2-ylsulfanyl-3-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-allyl-2-(isopropylthio)-5H-pyrimid[5,4-b]indol-4-one Formula: C16H17N3OS MolecularWeight: 299.39068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3OS/c1-4-9-19-15(20)14-13(18-16(19)21-10(2)3)11-7-5-6-8-12(11)17-14/h4-8,10,17H,1,9H2,2-3H3