(5E)-1-phenethyl-5-[[1-(phenylmethyl)indol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5E)-1-phenethyl-5-[[1-(phenylmethyl)indol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-5-[(1-benzylindol-3-yl)methylene]-1-phenethyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-1-phenethyl-5-[[1-(phenylmethyl)-3-indolyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-5-[(1-benzylindol-3-yl)methylene]-1-phenethyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C28H23N3O2S MolecularWeight: 465.56612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)C(=O)NC2=S

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)/C(=C/C3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)/C(=O)NC2=S

InChI

InChI=1S/C28H23N3O2S/c32-26-24(27(33)31(28(34)29-26)16-15-20-9-3-1-4-10-20)17-22-19-30(18-21-11-5-2-6-12-21)25-14-8-7-13-23(22)25/h1-14,17,19H,15-16,18H2,(H,29,32,34)/b24-17+