10-(phenylmethyl)-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-4-one

Systemtic Name: 10-(phenylmethyl)-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-4-one Openeye Name: 10-benzyl-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-4-one CAS Name: 10-(phenylmethyl)-2-(4-pyrimidinyl)-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-4-one IUPAC Name: 10-benzyl-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-4-one Traditional Name: 10-benzyl-2-(4-pyrimidyl)-7,8,9,10-tetrahydro-6H-pyrimid[1,2-a]azepin-4-one Formula: C20H20N4O MolecularWeight: 332.399

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN2C(=O)C=C(N=C2C(C1)CC3=CC=CC=C3)C4=NC=NC=C4

Isomeric SMILES

C1CCN2C(=O)C=C(N=C2C(C1)CC3=CC=CC=C3)C4=NC=NC=C4

InChI

InChI=1S/C20H20N4O/c25-19-13-18(17-9-10-21-14-22-17)23-20-16(8-4-5-11-24(19)20)12-15-6-2-1-3-7-15/h1-3,6-7,9-10,13-14,16H,4-5,8,11-12H2