5-[[4-(diethylamino)-2-oxidanyl-phenyl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[4-(diethylamino)-2-oxidanyl-phenyl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-allyl-5-[[4-(diethylamino)-2-hydroxy-phenyl]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[4-(diethylamino)-2-hydroxyphenyl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[4-(diethylamino)-2-hydroxyphenyl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-allyl-5-[4-(diethylamino)-2-hydroxy-benzylidene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)CC=C)O

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)CC=C)O

InChI

InChI=1S/C18H21N3O3S/c1-4-9-21-17(24)14(16(23)19-18(21)25)10-12-7-8-13(11-15(12)22)20(5-2)6-3/h4,7-8,10-11,22H,1,5-6,9H2,2-3H3,(H,19,23,25)