3-bromanyl-4-butylsulfanyl-2-methyl-5-prop-1-ynyl-thiophene

Systemtic Name: 3-bromanyl-4-butylsulfanyl-2-methyl-5-prop-1-ynyl-thiophene Openeye Name: 3-bromo-4-butylsulfanyl-2-methyl-5-prop-1-ynyl-thiophene CAS Name: 3-bromo-4-(butylthio)-2-methyl-5-prop-1-ynylthiophene IUPAC Name: 3-bromo-4-butylsulfanyl-2-methyl-5-prop-1-ynylthiophene Traditional Name: 3-bromo-4-(butylthio)-2-methyl-5-prop-1-ynyl-thiophene Formula: C12H15BrS2 MolecularWeight: 303.2815

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(SC(=C1Br)C)C#CC

Isomeric SMILES

CCCCSC1=C(SC(=C1Br)C)C#CC

InChI

InChI=1S/C12H15BrS2/c1-4-6-8-14-12-10(7-5-2)15-9(3)11(12)13/h4,6,8H2,1-3H3