4-oxidanylidene-3-(phenylmethyl)-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile Openeye Name: 3-benzyl-4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile CAS Name: 4-oxo-3-(phenylmethyl)-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile IUPAC Name: 3-benzyl-4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]indolizine-10-carbonitrile Traditional Name: 3-benzyl-4-keto-6,7,8,9-tetrahydropyrimid[4,5-b]indolizine-10-carbonitrile Formula: C18H16N4O MolecularWeight: 304.34584

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN2C(=C(C3=C2C(=O)N(C=N3)CC4=CC=CC=C4)C#N)C1

Isomeric SMILES

C1CCN2C(=C(C3=C2C(=O)N(C=N3)CC4=CC=CC=C4)C#N)C1

InChI

InChI=1S/C18H16N4O/c19-10-14-15-8-4-5-9-22(15)17-16(14)20-12-21(18(17)23)11-13-6-2-1-3-7-13/h1-3,6-7,12H,4-5,8-9,11H2