2-but-3-enyl-4-methoxy-6-methyl-pyrimidine; 4-methylbenzenesulfonamide

Systemtic Name: 2-but-3-enyl-4-methoxy-6-methyl-pyrimidine; 4-methylbenzenesulfonamide Openeye Name: 2-but-3-enyl-4-methoxy-6-methyl-pyrimidine; 4-methylbenzenesulfonamide CAS Name: 2-but-3-enyl-4-methoxy-6-methylpyrimidine; 4-methylbenzenesulfonamide IUPAC Name: 2-but-3-enyl-4-methoxy-6-methylpyrimidine; 4-methylbenzenesulfonamide Traditional Name: 2-but-3-enyl-4-methoxy-6-methyl-pyrimidine; 4-methylbenzenesulfonamide Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N.CC1=CC(=NC(=N1)CCC=C)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N.CC1=CC(=NC(=N1)CCC=C)OC

InChI

InChI=1S/C10H14N2O.C7H9NO2S/c1-4-5-6-9-11-8(2)7-10(12-9)13-3;1-6-2-4-7(5-3-6)11(8,9)10/h4,7H,1,5-6H2,2-3H3;2-5H,1H3,(H2,8,9,10)