5-(1H-benzimidazol-2-ylmethyl)-2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-1H-pyrimidin-6-one

Systemtic Name: 5-(1H-benzimidazol-2-ylmethyl)-2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-1H-pyrimidin-6-one Openeye Name: 5-(1H-benzimidazol-2-ylmethyl)-2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-1H-pyrimidin-6-one CAS Name: 5-(1H-benzimidazol-2-ylmethyl)-2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-1H-pyrimidin-6-one IUPAC Name: 5-(1H-benzimidazol-2-ylmethyl)-2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-1H-pyrimidin-6-one Traditional Name: 5-(1H-benzimidazol-2-ylmethyl)-2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-1H-pyrimidin-6-one Formula: C19H21N7OS MolecularWeight: 395.48134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCNC2=NC=C(C(=O)N2)CC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(N=CN1)CSCCNC2=NC=C(C(=O)N2)CC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H21N7OS/c1-12-16(23-11-22-12)10-28-7-6-20-19-21-9-13(18(27)26-19)8-17-24-14-4-2-3-5-15(14)25-17/h2-5,9,11H,6-8,10H2,1H3,(H,22,23)(H,24,25)(H2,20,21,26,27)