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

Systemtic Name: 2-[2-[(4-chloranyl-1,2,5-thiadiazol-3-yl)methylsulfanyl]ethylamino]-5-phenethyl-1H-pyrimidin-6-one Openeye Name: 2-[2-[(4-chloro-1,2,5-thiadiazol-3-yl)methylsulfanyl]ethylamino]-5-phenethyl-1H-pyrimidin-6-one CAS Name: 2-[2-[(4-chloro-1,2,5-thiadiazol-3-yl)methylthio]ethylamino]-5-phenethyl-1H-pyrimidin-6-one IUPAC Name: 2-[2-[(4-chloro-1,2,5-thiadiazol-3-yl)methylsulfanyl]ethylamino]-5-phenethyl-1H-pyrimidin-6-one Traditional Name: 2-[2-[(4-chloro-1,2,5-thiadiazol-3-yl)methylthio]ethylamino]-5-phenethyl-1H-pyrimidin-6-one Formula: C17H18ClN5OS2 MolecularWeight: 407.94072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CN=C(NC2=O)NCCSCC3=NSN=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CN=C(NC2=O)NCCSCC3=NSN=C3Cl

InChI

InChI=1S/C17H18ClN5OS2/c18-15-14(22-26-23-15)11-25-9-8-19-17-20-10-13(16(24)21-17)7-6-12-4-2-1-3-5-12/h1-5,10H,6-9,11H2,(H2,19,20,21,24)