4-[4-[2-(3-aminophenyl)ethyl]piperazin-1-yl]-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile

Systemtic Name: 4-[4-[2-(3-aminophenyl)ethyl]piperazin-1-yl]-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile Openeye Name: 4-[4-[2-(3-aminophenyl)ethyl]piperazin-1-yl]-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile CAS Name: 4-[4-[2-(3-aminophenyl)ethyl]-1-piperazinyl]-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile IUPAC Name: 4-[4-[2-(3-aminophenyl)ethyl]piperazin-1-yl]-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile Traditional Name: 4-[4-[2-(3-aminophenyl)ethyl]piperazino]-6,7,8,9-tetrahydropyrimid[4,5-b]indolizine-10-carbonitrile Formula: C23H27N7 MolecularWeight: 401.50738

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN2C(=C(C3=C2C(=NC=N3)N4CCN(CC4)CCC5=CC(=CC=C5)N)C#N)C1

Isomeric SMILES

C1CCN2C(=C(C3=C2C(=NC=N3)N4CCN(CC4)CCC5=CC(=CC=C5)N)C#N)C1

InChI

InChI=1S/C23H27N7/c24-15-19-20-6-1-2-8-30(20)22-21(19)26-16-27-23(22)29-12-10-28(11-13-29)9-7-17-4-3-5-18(25)14-17/h3-5,14,16H,1-2,6-13,25H2