6-azanyl-3-ethyl-5-[2-[(2-methyl-5-prop-2-enylsulfonyl-phenyl)amino]ethanoyl]-1-(phenylmethyl)pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-3-ethyl-5-[2-[(2-methyl-5-prop-2-enylsulfonyl-phenyl)amino]ethanoyl]-1-(phenylmethyl)pyrimidine-2,4-dione Openeye Name: 5-[2-(5-allylsulfonyl-2-methyl-anilino)acetyl]-6-amino-1-benzyl-3-ethyl-pyrimidine-2,4-dione CAS Name: 6-amino-3-ethyl-5-[2-(2-methyl-5-prop-2-enylsulfonylanilino)-1-oxoethyl]-1-(phenylmethyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-1-benzyl-3-ethyl-5-[2-(2-methyl-5-prop-2-enylsulfonylanilino)acetyl]pyrimidine-2,4-dione Traditional Name: 5-[2-(5-allylsulfonyl-2-methyl-anilino)acetyl]-6-amino-1-benzyl-3-ethyl-pyrimidine-2,4-quinone Formula: C25H28N4O5S MolecularWeight: 496.57862

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(N(C1=O)CC2=CC=CC=C2)N)C(=O)CNC3=C(C=CC(=C3)S(=O)(=O)CC=C)C

Isomeric SMILES

CCN1C(=O)C(=C(N(C1=O)CC2=CC=CC=C2)N)C(=O)CNC3=C(C=CC(=C3)S(=O)(=O)CC=C)C

InChI

InChI=1S/C25H28N4O5S/c1-4-13-35(33,34)19-12-11-17(3)20(14-19)27-15-21(30)22-23(26)29(16-18-9-7-6-8-10-18)25(32)28(5-2)24(22)31/h4,6-12,14,27H,1,5,13,15-16,26H2,2-3H3