3-[2-(1H-imidazol-5-yl)ethyl]-5,8-dimethyl-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-[2-(1H-imidazol-5-yl)ethyl]-5,8-dimethyl-pyrimido[5,4-b]indol-4-one Openeye Name: 3-[2-(1H-imidazol-5-yl)ethyl]-5,8-dimethyl-pyrimido[5,4-b]indol-4-one CAS Name: 3-[2-(1H-imidazol-5-yl)ethyl]-5,8-dimethyl-4-pyrimido[5,4-b]indolone IUPAC Name: 3-[2-(1H-imidazol-5-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one Traditional Name: 3-[2-(1H-imidazol-5-yl)ethyl]-5,8-dimethyl-pyrimid[5,4-b]indol-4-one Formula: C17H17N5O MolecularWeight: 307.34978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C3=C2N=CN(C3=O)CCC4=CN=CN4)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C3=C2N=CN(C3=O)CCC4=CN=CN4)C

InChI

InChI=1S/C17H17N5O/c1-11-3-4-14-13(7-11)15-16(21(14)2)17(23)22(10-20-15)6-5-12-8-18-9-19-12/h3-4,7-10H,5-6H2,1-2H3,(H,18,19)