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

Systemtic Name: 1-butyl-5-[[1-(phenylmethyl)indol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(1-benzylindol-3-yl)methylene]-1-butyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-butyl-5-[[1-(phenylmethyl)-3-indolyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(1-benzylindol-3-yl)methylidene]-1-butyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(1-benzylindol-3-yl)methylene]-1-butyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C24H23N3O2S MolecularWeight: 417.52332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)C(=O)NC1=S

Isomeric SMILES

CCCCN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)C(=O)NC1=S

InChI

InChI=1S/C24H23N3O2S/c1-2-3-13-27-23(29)20(22(28)25-24(27)30)14-18-16-26(15-17-9-5-4-6-10-17)21-12-8-7-11-19(18)21/h4-12,14,16H,2-3,13,15H2,1H3,(H,25,28,30)