1-(4-butoxyphenyl)sulfanyl-3-imidazol-1-yl-propan-1-ol

Systemtic Name: 1-(4-butoxyphenyl)sulfanyl-3-imidazol-1-yl-propan-1-ol Openeye Name: 1-(4-butoxyphenyl)sulfanyl-3-imidazol-1-yl-propan-1-ol CAS Name: 1-[(4-butoxyphenyl)thio]-3-(1-imidazolyl)-1-propanol IUPAC Name: 1-(4-butoxyphenyl)sulfanyl-3-imidazol-1-ylpropan-1-ol Traditional Name: 1-[(4-butoxyphenyl)thio]-3-imidazol-1-yl-propan-1-ol Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)SC(CCN2C=CN=C2)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)SC(CCN2C=CN=C2)O

InChI

InChI=1S/C16H22N2O2S/c1-2-3-12-20-14-4-6-15(7-5-14)21-16(19)8-10-18-11-9-17-13-18/h4-7,9,11,13,16,19H,2-3,8,10,12H2,1H3