2-[1-(4-butan-2-ylphenyl)ethylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[1-(4-butan-2-ylphenyl)ethylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[1-(4-sec-butylphenyl)ethylsulfanyl]-1,3-benzothiazole CAS Name: 2-[1-(4-butan-2-ylphenyl)ethylthio]-1,3-benzothiazole IUPAC Name: 2-[1-(4-butan-2-ylphenyl)ethylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[1-(4-sec-butylphenyl)ethylthio]-1,3-benzothiazole Formula: C19H21NS2 MolecularWeight: 327.50674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(C)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(C)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H21NS2/c1-4-13(2)15-9-11-16(12-10-15)14(3)21-19-20-17-7-5-6-8-18(17)22-19/h5-14H,4H2,1-3H3