3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2H-1,2,4-triazin-5-one

Systemtic Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2H-1,2,4-triazin-5-one Openeye Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]sulfanyl-6-methyl-2H-1,2,4-triazin-5-one CAS Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thio]-6-methyl-2H-1,2,4-triazin-5-one IUPAC Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-6-methyl-2H-1,2,4-triazin-5-one Traditional Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thio]-6-methyl-2H-1,2,4-triazin-5-one Formula: C15H16N4O2S MolecularWeight: 316.37814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)SCC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC1=NNC(=NC1=O)SCC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C15H16N4O2S/c1-10-14(21)16-15(18-17-10)22-9-13(20)19-7-6-11-4-2-3-5-12(11)8-19/h2-5H,6-9H2,1H3,(H,16,18,21)