6-azanyl-N-(2,4-dimethylphenyl)-2-morpholin-4-yl-4-oxidanylidene-1H-pyrimidine-5-carbothioamide

Systemtic Name: 6-azanyl-N-(2,4-dimethylphenyl)-2-morpholin-4-yl-4-oxidanylidene-1H-pyrimidine-5-carbothioamide Openeye Name: 6-amino-N-(2,4-dimethylphenyl)-2-morpholino-4-oxo-1H-pyrimidine-5-carbothioamide CAS Name: 6-amino-N-(2,4-dimethylphenyl)-2-(4-morpholinyl)-4-oxo-1H-pyrimidine-5-carbothioamide IUPAC Name: 6-amino-N-(2,4-dimethylphenyl)-2-morpholin-4-yl-4-oxo-1H-pyrimidine-5-carbothioamide Traditional Name: 6-amino-N-(2,4-dimethylphenyl)-4-keto-2-morpholino-1H-pyrimidine-5-carbothioamide Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)C2=C(NC(=NC2=O)N3CCOCC3)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)C2=C(NC(=NC2=O)N3CCOCC3)N)C

InChI

InChI=1S/C17H21N5O2S/c1-10-3-4-12(11(2)9-10)19-16(25)13-14(18)20-17(21-15(13)23)22-5-7-24-8-6-22/h3-4,9H,5-8H2,1-2H3,(H,19,25)(H3,18,20,21,23)