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

Systemtic Name: 5-[(4-ethanoylphenyl)iminomethyl]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(4-acetylphenyl)iminomethyl]-1-(4-ethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(4-acetylphenyl)iminomethyl]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(4-acetylphenyl)iminomethyl]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(4-acetylphenyl)iminomethyl]-1-(4-ethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H19N3O3S MolecularWeight: 393.45886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=S)C=NC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=S)C=NC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H19N3O3S/c1-3-14-4-10-17(11-5-14)24-20(27)18(19(26)23-21(24)28)12-22-16-8-6-15(7-9-16)13(2)25/h4-12,18H,3H2,1-2H3,(H,23,26,28)