4-[4-[3-methyl-2,4,6-tris(oxidanylidene)-1,3,5-triazinan-1-yl]phenyl]sulfanylbenzenecarbonitrile

Systemtic Name: 4-[4-[3-methyl-2,4,6-tris(oxidanylidene)-1,3,5-triazinan-1-yl]phenyl]sulfanylbenzenecarbonitrile Openeye Name: 4-[4-(3-methyl-2,4,6-trioxo-1,3,5-triazinan-1-yl)phenyl]sulfanylbenzonitrile CAS Name: 4-[[4-(3-methyl-2,4,6-trioxo-1,3,5-triazinan-1-yl)phenyl]thio]benzonitrile IUPAC Name: 4-[4-(3-methyl-2,4,6-trioxo-1,3,5-triazinan-1-yl)phenyl]sulfanylbenzonitrile Traditional Name: 4-[[4-(2,4,6-triketo-3-methyl-1,3,5-triazinan-1-yl)phenyl]thio]benzonitrile Formula: C17H12N4O3S MolecularWeight: 352.36718

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)SC3=CC=C(C=C3)C#N

Isomeric SMILES

CN1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)SC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H12N4O3S/c1-20-15(22)19-16(23)21(17(20)24)12-4-8-14(9-5-12)25-13-6-2-11(10-18)3-7-13/h2-9H,1H3,(H,19,22,23)