(2-butyl-4-propan-2-yl-phenyl)methanethiol

Systemtic Name: (2-butyl-4-propan-2-yl-phenyl)methanethiol Openeye Name: (2-butyl-4-isopropyl-phenyl)methanethiol CAS Name: (2-butyl-4-propan-2-ylphenyl)methanethiol IUPAC Name: (2-butyl-4-propan-2-ylphenyl)methanethiol Traditional Name: (2-butyl-4-isopropyl-phenyl)methanethiol Formula: C14H22S MolecularWeight: 222.38948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)C(C)C)CS

Isomeric SMILES

CCCCC1=C(C=CC(=C1)C(C)C)CS

InChI

InChI=1S/C14H22S/c1-4-5-6-13-9-12(11(2)3)7-8-14(13)10-15/h7-9,11,15H,4-6,10H2,1-3H3