2-methyl-3-[(E)-(4-prop-2-enoxyphenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 2-methyl-3-[(E)-(4-prop-2-enoxyphenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-[(E)-(4-allyloxyphenyl)methyleneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 2-methyl-3-[(E)-(4-prop-2-enoxyphenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 2-methyl-3-[(E)-(4-prop-2-enoxyphenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-[(E)-(4-allyloxybenzylidene)amino]-2-methyl-5H-pyrimid[5,4-b]indol-4-one Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=O)N1N=CC3=CC=C(C=C3)OCC=C)NC4=CC=CC=C42

Isomeric SMILES

CC1=NC2=C(C(=O)N1/N=C/C3=CC=C(C=C3)OCC=C)NC4=CC=CC=C42

InChI

InChI=1S/C21H18N4O2/c1-3-12-27-16-10-8-15(9-11-16)13-22-25-14(2)23-19-17-6-4-5-7-18(17)24-20(19)21(25)26/h3-11,13,24H,1,12H2,2H3/b22-13+