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

Systemtic Name: 6-azanyl-N-(4-chlorophenyl)-2-morpholin-4-yl-4-oxidanylidene-1H-pyrimidine-5-carbothioamide Openeye Name: 6-amino-N-(4-chlorophenyl)-2-morpholino-4-oxo-1H-pyrimidine-5-carbothioamide CAS Name: 6-amino-N-(4-chlorophenyl)-2-(4-morpholinyl)-4-oxo-1H-pyrimidine-5-carbothioamide IUPAC Name: 6-amino-N-(4-chlorophenyl)-2-morpholin-4-yl-4-oxo-1H-pyrimidine-5-carbothioamide Traditional Name: 6-amino-N-(4-chlorophenyl)-4-keto-2-morpholino-1H-pyrimidine-5-carbothioamide Formula: C15H16ClN5O2S MolecularWeight: 365.83784

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=O)C(=C(N2)N)C(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1COCCN1C2=NC(=O)C(=C(N2)N)C(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H16ClN5O2S/c16-9-1-3-10(4-2-9)18-14(24)11-12(17)19-15(20-13(11)22)21-5-7-23-8-6-21/h1-4H,5-8H2,(H,18,24)(H3,17,19,20,22)