6-methyl-5-(pyridin-3-ylmethyl)-2-[2-(1,3-thiazol-2-ylmethylsulfanyl)ethylamino]-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-5-(pyridin-3-ylmethyl)-2-[2-(1,3-thiazol-2-ylmethylsulfanyl)ethylamino]-1H-pyrimidin-4-one Openeye Name: 6-methyl-5-(3-pyridylmethyl)-2-[2-(thiazol-2-ylmethylsulfanyl)ethylamino]-1H-pyrimidin-4-one CAS Name: 6-methyl-5-(3-pyridinylmethyl)-2-[2-(2-thiazolylmethylthio)ethylamino]-1H-pyrimidin-4-one IUPAC Name: 6-methyl-5-(pyridin-3-ylmethyl)-2-[2-(1,3-thiazol-2-ylmethylsulfanyl)ethylamino]-1H-pyrimidin-4-one Traditional Name: 6-methyl-5-(3-pyridylmethyl)-2-[2-(thiazol-2-ylmethylthio)ethylamino]-1H-pyrimidin-4-one Formula: C17H19N5OS2 MolecularWeight: 373.49566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)NCCSCC2=NC=CS2)CC3=CN=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)NCCSCC2=NC=CS2)CC3=CN=CC=C3

InChI

InChI=1S/C17H19N5OS2/c1-12-14(9-13-3-2-4-18-10-13)16(23)22-17(21-12)20-5-7-24-11-15-19-6-8-25-15/h2-4,6,8,10H,5,7,9,11H2,1H3,(H2,20,21,22,23)