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

Systemtic Name: 4-[4-(2,2-diphenylethanoyl)piperazin-1-yl]-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile Openeye Name: 4-[4-(2,2-diphenylacetyl)piperazin-1-yl]-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile CAS Name: 4-[4-(1-oxo-2,2-diphenylethyl)-1-piperazinyl]-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile IUPAC Name: 4-[4-(2,2-diphenylacetyl)piperazin-1-yl]-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile Traditional Name: 4-[4-(2,2-diphenylacetyl)piperazino]-6,7,8,9-tetrahydropyrimid[4,5-b]indolizine-10-carbonitrile Formula: C29H28N6O MolecularWeight: 476.57222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN2C(=C(C3=C2C(=NC=N3)N4CCN(CC4)C(=O)C(C5=CC=CC=C5)C6=CC=CC=C6)C#N)C1

Isomeric SMILES

C1CCN2C(=C(C3=C2C(=NC=N3)N4CCN(CC4)C(=O)C(C5=CC=CC=C5)C6=CC=CC=C6)C#N)C1

InChI

InChI=1S/C29H28N6O/c30-19-23-24-13-7-8-14-35(24)27-26(23)31-20-32-28(27)33-15-17-34(18-16-33)29(36)25(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-6,9-12,20,25H,7-8,13-18H2