2,3-dimethoxy-N-(4-oxidanylidene-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)benzamide

Systemtic Name: 2,3-dimethoxy-N-(4-oxidanylidene-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)benzamide Openeye Name: 2,3-dimethoxy-N-(4-oxo-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)benzamide CAS Name: 2,3-dimethoxy-N-[4-oxo-2-(4-pyrimidinyl)-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl]benzamide IUPAC Name: 2,3-dimethoxy-N-(4-oxo-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)benzamide Traditional Name: N-[4-keto-2-(4-pyrimidyl)-7,8,9,10-tetrahydro-6H-pyrimid[1,2-a]azepin-10-yl]-2,3-dimethoxy-benzamide Formula: C22H23N5O4 MolecularWeight: 421.44912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(=O)NC2CCCCN3C2=NC(=CC3=O)C4=NC=NC=C4

Isomeric SMILES

COC1=CC=CC(=C1OC)C(=O)NC2CCCCN3C2=NC(=CC3=O)C4=NC=NC=C4

InChI

InChI=1S/C22H23N5O4/c1-30-18-8-5-6-14(20(18)31-2)22(29)26-16-7-3-4-11-27-19(28)12-17(25-21(16)27)15-9-10-23-13-24-15/h5-6,8-10,12-13,16H,3-4,7,11H2,1-2H3,(H,26,29)