5-[[1-(phenylmethyl)-3,4-dihydro-2H-quinolin-6-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[1-(phenylmethyl)-3,4-dihydro-2H-quinolin-6-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(1-benzyl-3,4-dihydro-2H-quinolin-6-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[1-(phenylmethyl)-3,4-dihydro-2H-quinolin-6-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(1-benzyl-3,4-dihydro-2H-quinolin-6-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(1-benzyl-3,4-dihydro-2H-quinolin-6-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C=C3C(=O)NC(=S)NC3=O)N(C1)CC4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C=CC(=C2)C=C3C(=O)NC(=S)NC3=O)N(C1)CC4=CC=CC=C4

InChI

InChI=1S/C21H19N3O2S/c25-19-17(20(26)23-21(27)22-19)12-15-8-9-18-16(11-15)7-4-10-24(18)13-14-5-2-1-3-6-14/h1-3,5-6,8-9,11-12H,4,7,10,13H2,(H2,22,23,25,26,27)