2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(4-methyl-3-morpholin-4-ylcarbonyl-5-phenyl-thiophen-2-yl)ethanamide

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(4-methyl-3-morpholin-4-ylcarbonyl-5-phenyl-thiophen-2-yl)ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[4-methyl-3-(morpholine-4-carbonyl)-5-phenyl-2-thienyl]acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-[4-methyl-3-[4-morpholinyl(oxo)methyl]-5-phenyl-2-thiophenyl]acetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[4-methyl-3-(morpholine-4-carbonyl)-5-phenylthiophen-2-yl]acetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-[4-methyl-3-(morpholine-4-carbonyl)-5-phenyl-2-thienyl]acetamide Formula: C22H23N5O4S2 MolecularWeight: 485.57912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N2CCOCC2)NC(=O)CSC3=NC(=O)C=C(N3)N)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=C1C(=O)N2CCOCC2)NC(=O)CSC3=NC(=O)C=C(N3)N)C4=CC=CC=C4

InChI

InChI=1S/C22H23N5O4S2/c1-13-18(21(30)27-7-9-31-10-8-27)20(33-19(13)14-5-3-2-4-6-14)25-17(29)12-32-22-24-15(23)11-16(28)26-22/h2-6,11H,7-10,12H2,1H3,(H,25,29)(H3,23,24,26,28)