1-[4-(4-nitrophenyl)sulfinylphenyl]-3-propyl-1,3,5-triazinane-2,4,6-trione

Systemtic Name: 1-[4-(4-nitrophenyl)sulfinylphenyl]-3-propyl-1,3,5-triazinane-2,4,6-trione Openeye Name: 1-[4-(4-nitrophenyl)sulfinylphenyl]-3-propyl-1,3,5-triazinane-2,4,6-trione CAS Name: 1-[4-(4-nitrophenyl)sulfinylphenyl]-3-propyl-1,3,5-triazinane-2,4,6-trione IUPAC Name: 1-[4-(4-nitrophenyl)sulfinylphenyl]-3-propyl-1,3,5-triazinane-2,4,6-trione Traditional Name: 1-[4-(4-nitrophenyl)sulfinylphenyl]-3-propyl-isocyanuric acid Formula: C18H16N4O6S MolecularWeight: 416.40784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)S(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)S(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O6S/c1-2-11-20-16(23)19-17(24)21(18(20)25)12-3-7-14(8-4-12)29(28)15-9-5-13(6-10-15)22(26)27/h3-10H,2,11H2,1H3,(H,19,23,24)