4-ethoxy-2-piperazin-1-yl-7-pyridin-3-yl-5H-pyrimido[5,4-b]indole

Systemtic Name: 4-ethoxy-2-piperazin-1-yl-7-pyridin-3-yl-5H-pyrimido[5,4-b]indole Openeye Name: 4-ethoxy-2-piperazin-1-yl-7-(3-pyridyl)-5H-pyrimido[5,4-b]indole CAS Name: 4-ethoxy-2-(1-piperazinyl)-7-(3-pyridinyl)-5H-pyrimido[5,4-b]indole IUPAC Name: 4-ethoxy-2-piperazin-1-yl-7-pyridin-3-yl-5H-pyrimido[5,4-b]indole Traditional Name: 4-ethoxy-2-piperazino-7-(3-pyridyl)-5H-pyrimid[5,4-b]indole Formula: C21H22N6O MolecularWeight: 374.43898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC2=C1NC3=C2C=CC(=C3)C4=CN=CC=C4)N5CCNCC5

Isomeric SMILES

CCOC1=NC(=NC2=C1NC3=C2C=CC(=C3)C4=CN=CC=C4)N5CCNCC5

InChI

InChI=1S/C21H22N6O/c1-2-28-20-19-18(25-21(26-20)27-10-8-22-9-11-27)16-6-5-14(12-17(16)24-19)15-4-3-7-23-13-15/h3-7,12-13,22,24H,2,8-11H2,1H3