2-(4-methylpentylsulfanyl)-5-propan-2-yl-1,3-benzothiazole

Systemtic Name: 2-(4-methylpentylsulfanyl)-5-propan-2-yl-1,3-benzothiazole Openeye Name: 2-isohexylsulfanyl-5-isopropyl-1,3-benzothiazole CAS Name: 2-(4-methylpentylthio)-5-propan-2-yl-1,3-benzothiazole IUPAC Name: 2-(4-methylpentylsulfanyl)-5-propan-2-yl-1,3-benzothiazole Traditional Name: 2-(isohexylthio)-5-isopropyl-1,3-benzothiazole Formula: C16H23NS2 MolecularWeight: 293.49052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCSC1=NC2=C(S1)C=CC(=C2)C(C)C

Isomeric SMILES

CC(C)CCCSC1=NC2=C(S1)C=CC(=C2)C(C)C

InChI

InChI=1S/C16H23NS2/c1-11(2)6-5-9-18-16-17-14-10-13(12(3)4)7-8-15(14)19-16/h7-8,10-12H,5-6,9H2,1-4H3