1-cyclohexyl-5-[[[4-(diethylamino)phenyl]amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-cyclohexyl-5-[[[4-(diethylamino)phenyl]amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-cyclohexyl-5-[[4-(diethylamino)anilino]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-cyclohexyl-5-[[4-(diethylamino)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-cyclohexyl-5-[[4-(diethylamino)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-cyclohexyl-5-[[4-(diethylamino)anilino]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC=C2C(=O)NC(=S)N(C2=O)C3CCCCC3

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC=C2C(=O)NC(=S)N(C2=O)C3CCCCC3

InChI

InChI=1S/C21H28N4O2S/c1-3-24(4-2)16-12-10-15(11-13-16)22-14-18-19(26)23-21(28)25(20(18)27)17-8-6-5-7-9-17/h10-14,17,22H,3-9H2,1-2H3,(H,23,26,28)