2-methoxy-N-(4-oxidanylidene-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)-5-sulfamoyl-benzamide

Systemtic Name: 2-methoxy-N-(4-oxidanylidene-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)-5-sulfamoyl-benzamide Openeye Name: 2-methoxy-N-(4-oxo-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)-5-sulfamoyl-benzamide CAS Name: 2-methoxy-N-[4-oxo-2-(4-pyrimidinyl)-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl]-5-sulfamoylbenzamide IUPAC Name: 2-methoxy-N-(4-oxo-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)-5-sulfamoylbenzamide Traditional Name: N-[4-keto-2-(4-pyrimidyl)-7,8,9,10-tetrahydro-6H-pyrimid[1,2-a]azepin-10-yl]-2-methoxy-5-sulfamoyl-benzamide Formula: C21H22N6O5S MolecularWeight: 470.50158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)NC2CCCCN3C2=NC(=CC3=O)C4=NC=NC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)NC2CCCCN3C2=NC(=CC3=O)C4=NC=NC=C4

InChI

InChI=1S/C21H22N6O5S/c1-32-18-6-5-13(33(22,30)31)10-14(18)21(29)26-16-4-2-3-9-27-19(28)11-17(25-20(16)27)15-7-8-23-12-24-15/h5-8,10-12,16H,2-4,9H2,1H3,(H,26,29)(H2,22,30,31)