2-sulfanylidene-5-[(triphenylmethyl)iminomethyl]-1,3-diazinane-4,6-dione

Systemtic Name: 2-sulfanylidene-5-[(triphenylmethyl)iminomethyl]-1,3-diazinane-4,6-dione Openeye Name: 2-thioxo-5-(trityliminomethyl)hexahydropyrimidine-4,6-dione CAS Name: 2-sulfanylidene-5-[(triphenylmethyl)iminomethyl]-1,3-diazinane-4,6-dione IUPAC Name: 2-sulfanylidene-5-(trityliminomethyl)-1,3-diazinane-4,6-dione Traditional Name: 2-thioxo-5-(trityliminomethyl)hexahydropyrimidine-4,6-quinone Formula: C24H19N3O2S MolecularWeight: 413.49156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N=CC4C(=O)NC(=S)NC4=O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N=CC4C(=O)NC(=S)NC4=O

InChI

InChI=1S/C24H19N3O2S/c28-21-20(22(29)27-23(30)26-21)16-25-24(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16,20H,(H2,26,27,28,29,30)