3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)-N-(6-phenoxy-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)-N-(6-phenoxy-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)-N-(6-phenoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)-N-(6-phenoxy-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)-N-(6-phenoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(4-keto-2,6-dimethyl-1H-pyrimidin-5-yl)-N-(6-phenoxy-1,3-benzothiazol-2-yl)propionamide Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C22H20N4O3S/c1-13-17(21(28)24-14(2)23-13)9-11-20(27)26-22-25-18-10-8-16(12-19(18)30-22)29-15-6-4-3-5-7-15/h3-8,10,12H,9,11H2,1-2H3,(H,23,24,28)(H,25,26,27)