5-chloranyl-2-(4-methylphthalazin-1-yl)sulfanyl-1,3-benzothiazole

Systemtic Name: 5-chloranyl-2-(4-methylphthalazin-1-yl)sulfanyl-1,3-benzothiazole Openeye Name: 5-chloro-2-(4-methylphthalazin-1-yl)sulfanyl-1,3-benzothiazole CAS Name: 5-chloro-2-[(4-methyl-1-phthalazinyl)thio]-1,3-benzothiazole IUPAC Name: 5-chloro-2-(4-methylphthalazin-1-yl)sulfanyl-1,3-benzothiazole Traditional Name: 5-chloro-2-[(4-methylphthalazin-1-yl)thio]-1,3-benzothiazole Formula: C16H10ClN3S2 MolecularWeight: 343.8537

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C2=CC=CC=C12)SC3=NC4=C(S3)C=CC(=C4)Cl

Isomeric SMILES

CC1=NN=C(C2=CC=CC=C12)SC3=NC4=C(S3)C=CC(=C4)Cl

InChI

InChI=1S/C16H10ClN3S2/c1-9-11-4-2-3-5-12(11)15(20-19-9)22-16-18-13-8-10(17)6-7-14(13)21-16/h2-8H,1H3