6-azanyl-5-[2-(phenylmethylsulfanyl)ethanoyl]-1-propyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-(phenylmethylsulfanyl)ethanoyl]-1-propyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-(2-benzylsulfanylacetyl)-1-propyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[1-oxo-2-(phenylmethylthio)ethyl]-1-propylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-(2-benzylsulfanylacetyl)-1-propylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-(benzylthio)acetyl]-1-propyl-pyrimidine-2,4-quinone Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)C(=O)CSCC2=CC=CC=C2)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)C(=O)CSCC2=CC=CC=C2)N

InChI

InChI=1S/C16H19N3O3S/c1-2-8-19-14(17)13(15(21)18-16(19)22)12(20)10-23-9-11-6-4-3-5-7-11/h3-7H,2,8-10,17H2,1H3,(H,18,21,22)