4-(4-phenylpiperazin-1-yl)-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile

Systemtic Name: 4-(4-phenylpiperazin-1-yl)-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile Openeye Name: 4-(4-phenylpiperazin-1-yl)-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile CAS Name: 4-(4-phenyl-1-piperazinyl)-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile IUPAC Name: 4-(4-phenylpiperazin-1-yl)-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile Traditional Name: 4-(4-phenylpiperazino)-6,7,8,9-tetrahydropyrimid[4,5-b]indolizine-10-carbonitrile Formula: C21H22N6 MolecularWeight: 358.43958

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN2C(=C(C3=C2C(=NC=N3)N4CCN(CC4)C5=CC=CC=C5)C#N)C1

Isomeric SMILES

C1CCN2C(=C(C3=C2C(=NC=N3)N4CCN(CC4)C5=CC=CC=C5)C#N)C1

InChI

InChI=1S/C21H22N6/c22-14-17-18-8-4-5-9-27(18)20-19(17)23-15-24-21(20)26-12-10-25(11-13-26)16-6-2-1-3-7-16/h1-3,6-7,15H,4-5,8-13H2