N-[(E)-ethylideneamino]-2,6-dimethyl-pyrimidin-4-amine; methanesulfonamide; methylbenzene; phenol

Systemtic Name: N-[(E)-ethylideneamino]-2,6-dimethyl-pyrimidin-4-amine; methanesulfonamide; methylbenzene; phenol Openeye Name: N-[(E)-ethylideneamino]-2,6-dimethyl-pyrimidin-4-amine; methanesulfonamide; phenol; toluene CAS Name: N-[(E)-ethylideneamino]-2,6-dimethyl-4-pyrimidinamine; methanesulfonamide; phenol; toluene IUPAC Name: N-[(E)-ethylideneamino]-2,6-dimethylpyrimidin-4-amine; methanesulfonamide; phenol; toluene Traditional Name: (2,6-dimethylpyrimidin-4-yl)-[(E)-ethylideneamino]amine; methanesulfonamide; phenol; toluene Formula: C22H31N5O3S MolecularWeight: 445.57824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=NNC1=NC(=NC(=C1)C)C.CC1=CC=CC=C1.CS(=O)(=O)N.C1=CC=C(C=C1)O

Isomeric SMILES

C/C=N/NC1=NC(=NC(=C1)C)C.CC1=CC=CC=C1.CS(=O)(=O)N.C1=CC=C(C=C1)O

InChI

InChI=1S/C8H12N4.C7H8.C6H6O.CH5NO2S/c1-4-9-12-8-5-6(2)10-7(3)11-8;1-7-5-3-2-4-6-7;7-6-4-2-1-3-5-6;1-5(2,3)4/h4-5H,1-3H3,(H,10,11,12);2-6H,1H3;1-5,7H;1H3,(H2,2,3,4)/b9-4+;;;