2-(4-methylphthalazin-1-yl)sulfanyl-1,3-benzoxazole

Systemtic Name: 2-(4-methylphthalazin-1-yl)sulfanyl-1,3-benzoxazole Openeye Name: 2-(4-methylphthalazin-1-yl)sulfanyl-1,3-benzoxazole CAS Name: 2-[(4-methyl-1-phthalazinyl)thio]-1,3-benzoxazole IUPAC Name: 2-(4-methylphthalazin-1-yl)sulfanyl-1,3-benzoxazole Traditional Name: 2-[(4-methylphthalazin-1-yl)thio]-1,3-benzoxazole Formula: C16H11N3OS MolecularWeight: 293.34304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C2=CC=CC=C12)SC3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=NN=C(C2=CC=CC=C12)SC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C16H11N3OS/c1-10-11-6-2-3-7-12(11)15(19-18-10)21-16-17-13-8-4-5-9-14(13)20-16/h2-9H,1H3