4,7-dimethyl-2-(4-pyridin-2-ylbut-3-ynyl)-1,3-benzothiazole

Systemtic Name: 4,7-dimethyl-2-(4-pyridin-2-ylbut-3-ynyl)-1,3-benzothiazole Openeye Name: 4,7-dimethyl-2-[4-(2-pyridyl)but-3-ynyl]-1,3-benzothiazole CAS Name: 4,7-dimethyl-2-[4-(2-pyridinyl)but-3-ynyl]-1,3-benzothiazole IUPAC Name: 4,7-dimethyl-2-(4-pyridin-2-ylbut-3-ynyl)-1,3-benzothiazole Traditional Name: 4,7-dimethyl-2-[4-(2-pyridyl)but-3-ynyl]-1,3-benzothiazole Formula: C18H16N2S MolecularWeight: 292.39804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)SC(=N2)CCC#CC3=CC=CC=N3

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)CCC#CC3=CC=CC=N3

InChI

InChI=1S/C18H16N2S/c1-13-10-11-14(2)18-17(13)20-16(21-18)9-4-3-7-15-8-5-6-12-19-15/h5-6,8,10-12H,4,9H2,1-2H3