6-azanyl-2-[[1-(phenylmethyl)benzimidazol-2-yl]methylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[[1-(phenylmethyl)benzimidazol-2-yl]methylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[(1-benzylbenzimidazol-2-yl)methylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-amino-2-[[1-(phenylmethyl)-2-benzimidazolyl]methylthio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[(1-benzylbenzimidazol-2-yl)methylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[(1-benzylbenzimidazol-2-yl)methylthio]-1H-pyrimidin-4-one Formula: C19H17N5OS MolecularWeight: 363.43618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2CSC4=NC(=O)C=C(N4)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2CSC4=NC(=O)C=C(N4)N

InChI

InChI=1S/C19H17N5OS/c20-16-10-18(25)23-19(22-16)26-12-17-21-14-8-4-5-9-15(14)24(17)11-13-6-2-1-3-7-13/h1-10H,11-12H2,(H3,20,22,23,25)