6,6-diethyl-2-methyl-4-phenyl-3-sulfanylidene-1,2,4-triazepane-5,7-dione

Systemtic Name: 6,6-diethyl-2-methyl-4-phenyl-3-sulfanylidene-1,2,4-triazepane-5,7-dione Openeye Name: 6,6-diethyl-2-methyl-4-phenyl-3-thioxo-1,2,4-triazepane-5,7-dione CAS Name: 6,6-diethyl-2-methyl-4-phenyl-3-sulfanylidene-1,2,4-triazepane-5,7-dione IUPAC Name: 6,6-diethyl-2-methyl-4-phenyl-3-sulfanylidene-1,2,4-triazepane-5,7-dione Traditional Name: 6,6-diethyl-2-methyl-4-phenyl-3-thioxo-1,2,4-triazepane-5,7-quinone Formula: C15H19N3O2S MolecularWeight: 305.39526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)NN(C(=S)N(C1=O)C2=CC=CC=C2)C)CC

Isomeric SMILES

CCC1(C(=O)NN(C(=S)N(C1=O)C2=CC=CC=C2)C)CC

InChI

InChI=1S/C15H19N3O2S/c1-4-15(5-2)12(19)16-17(3)14(21)18(13(15)20)11-9-7-6-8-10-11/h6-10H,4-5H2,1-3H3,(H,16,19)