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

Systemtic Name: 1-cyclopropyl-5-[[1-(phenylmethyl)indol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(1-benzylindol-3-yl)methylene]-1-cyclopropyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-cyclopropyl-5-[[1-(phenylmethyl)-3-indolyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(1-benzylindol-3-yl)methylidene]-1-cyclopropyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(1-benzylindol-3-yl)methylene]-1-cyclopropyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C23H19N3O2S MolecularWeight: 401.48086

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)C(=O)NC2=S

Isomeric SMILES

C1CC1N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)C(=O)NC2=S

InChI

InChI=1S/C23H19N3O2S/c27-21-19(22(28)26(17-10-11-17)23(29)24-21)12-16-14-25(13-15-6-2-1-3-7-15)20-9-5-4-8-18(16)20/h1-9,12,14,17H,10-11,13H2,(H,24,27,29)