2-[2-[(5-azanyl-1,3,4-thiadiazol-2-yl)methylsulfanyl]ethylamino]-5-phenylmethoxy-1H-pyrimidin-6-one

Systemtic Name: 2-[2-[(5-azanyl-1,3,4-thiadiazol-2-yl)methylsulfanyl]ethylamino]-5-phenylmethoxy-1H-pyrimidin-6-one Openeye Name: 2-[2-[(5-amino-1,3,4-thiadiazol-2-yl)methylsulfanyl]ethylamino]-5-benzyloxy-1H-pyrimidin-6-one CAS Name: 2-[2-[(5-amino-1,3,4-thiadiazol-2-yl)methylthio]ethylamino]-5-phenylmethoxy-1H-pyrimidin-6-one IUPAC Name: 2-[2-[(5-amino-1,3,4-thiadiazol-2-yl)methylsulfanyl]ethylamino]-5-phenylmethoxy-1H-pyrimidin-6-one Traditional Name: 2-[2-[(5-amino-1,3,4-thiadiazol-2-yl)methylthio]ethylamino]-5-benzoxy-1H-pyrimidin-6-one Formula: C16H18N6O2S2 MolecularWeight: 390.48312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CN=C(NC2=O)NCCSCC3=NN=C(S3)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CN=C(NC2=O)NCCSCC3=NN=C(S3)N

InChI

InChI=1S/C16H18N6O2S2/c17-15-22-21-13(26-15)10-25-7-6-18-16-19-8-12(14(23)20-16)24-9-11-4-2-1-3-5-11/h1-5,8H,6-7,9-10H2,(H2,17,22)(H2,18,19,20,23)