N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-(8-methyl-4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)propanamide

Systemtic Name: N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-(8-methyl-4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)propanamide Openeye Name: N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-(8-methyl-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)propanamide CAS Name: N-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl]-3-(8-methyl-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)propanamide IUPAC Name: N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-3-(8-methyl-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)propanamide Traditional Name: N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-(4-keto-8-methyl-5H-pyrimid[5,4-b]indol-3-yl)propionamide Formula: C22H26N6O2 MolecularWeight: 406.48084

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CNC(=O)CCN2C=NC3=C(C2=O)NC4=C3C=C(C=C4)C)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CNC(=O)CCN2C=NC3=C(C2=O)NC4=C3C=C(C=C4)C)C

InChI

InChI=1S/C22H26N6O2/c1-5-28-15(4)17(14(3)26-28)11-23-19(29)8-9-27-12-24-20-16-10-13(2)6-7-18(16)25-21(20)22(27)30/h6-7,10,12,25H,5,8-9,11H2,1-4H3,(H,23,29)