6-azanyl-3-methyl-5-[2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-1-propyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-3-methyl-5-[2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-1-propyl-pyrimidine-2,4-dione Openeye Name: 5-[2-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-6-amino-3-methyl-1-propyl-pyrimidine-2,4-dione CAS Name: 6-amino-3-methyl-5-[1-oxo-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]ethyl]-1-propylpyrimidine-2,4-dione IUPAC Name: 6-amino-3-methyl-5-[2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-1-propylpyrimidine-2,4-dione Traditional Name: 5-[2-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]-6-amino-3-methyl-1-propyl-pyrimidine-2,4-quinone Formula: C20H23N7O3S MolecularWeight: 441.50672

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NN=C(N2CC=C)C3=CC=NC=C3)N

Isomeric SMILES

CCCN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NN=C(N2CC=C)C3=CC=NC=C3)N

InChI

InChI=1S/C20H23N7O3S/c1-4-10-26-16(21)15(18(29)25(3)20(26)30)14(28)12-31-19-24-23-17(27(19)11-5-2)13-6-8-22-9-7-13/h5-9H,2,4,10-12,21H2,1,3H3