S-(4-methylphthalazin-1-yl) 4-methoxybenzenecarbothioate

Systemtic Name: S-(4-methylphthalazin-1-yl) 4-methoxybenzenecarbothioate Openeye Name: S-(4-methylphthalazin-1-yl) 4-methoxybenzenecarbothioate CAS Name: 4-methoxybenzenecarbothioic acid S-(4-methyl-1-phthalazinyl) ester IUPAC Name: S-(4-methylphthalazin-1-yl) 4-methoxybenzenecarbothioate Traditional Name: 4-methoxythiobenzoic acid S-(4-methylphthalazin-1-yl) ester Formula: C17H14N2O2S MolecularWeight: 310.37026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C2=CC=CC=C12)SC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=NN=C(C2=CC=CC=C12)SC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C17H14N2O2S/c1-11-14-5-3-4-6-15(14)16(19-18-11)22-17(20)12-7-9-13(21-2)10-8-12/h3-10H,1-2H3