7-methoxy-4-(4-phenylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole

Systemtic Name: 7-methoxy-4-(4-phenylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole Openeye Name: 7-methoxy-4-(4-phenylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole CAS Name: 7-methoxy-4-(4-phenyl-1-piperazinyl)-5H-pyrimido[5,4-b]indole IUPAC Name: 7-methoxy-4-(4-phenylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole Traditional Name: 7-methoxy-4-(4-phenylpiperazino)-5H-pyrimid[5,4-b]indole Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(N2)C(=NC=N3)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(N2)C(=NC=N3)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C21H21N5O/c1-27-16-7-8-17-18(13-16)24-20-19(17)22-14-23-21(20)26-11-9-25(10-12-26)15-5-3-2-4-6-15/h2-8,13-14,24H,9-12H2,1H3