2-[4-(1-azanylethyl)phenyl]sulfanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[4-(1-azanylethyl)phenyl]sulfanyl-1H-pyrimidin-6-one Openeye Name: 2-[4-(1-aminoethyl)phenyl]sulfanyl-1H-pyrimidin-6-one CAS Name: 2-[[4-(1-aminoethyl)phenyl]thio]-1H-pyrimidin-6-one IUPAC Name: 2-[4-(1-aminoethyl)phenyl]sulfanyl-1H-pyrimidin-6-one Traditional Name: 2-[[4-(1-aminoethyl)phenyl]thio]-1H-pyrimidin-6-one Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC2=NC=CC(=O)N2)N

Isomeric SMILES

CC(C1=CC=C(C=C1)SC2=NC=CC(=O)N2)N

InChI

InChI=1S/C12H13N3OS/c1-8(13)9-2-4-10(5-3-9)17-12-14-7-6-11(16)15-12/h2-8H,13H2,1H3,(H,14,15,16)