N-[4-(1-imidazol-1-yl-4-pyridin-4-yl-butan-2-yl)sulfanylphenyl]ethanamide

Systemtic Name: N-[4-(1-imidazol-1-yl-4-pyridin-4-yl-butan-2-yl)sulfanylphenyl]ethanamide Openeye Name: N-[4-[1-(imidazol-1-ylmethyl)-3-(4-pyridyl)propyl]sulfanylphenyl]acetamide CAS Name: N-[4-[[1-(1-imidazolyl)-4-pyridin-4-ylbutan-2-yl]thio]phenyl]acetamide IUPAC Name: N-[4-(1-imidazol-1-yl-4-pyridin-4-ylbutan-2-yl)sulfanylphenyl]acetamide Traditional Name: N-[4-[[1-(imidazol-1-ylmethyl)-3-(4-pyridyl)propyl]thio]phenyl]acetamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SC(CCC2=CC=NC=C2)CN3C=CN=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SC(CCC2=CC=NC=C2)CN3C=CN=C3

InChI

InChI=1S/C20H22N4OS/c1-16(25)23-18-3-6-19(7-4-18)26-20(14-24-13-12-22-15-24)5-2-17-8-10-21-11-9-17/h3-4,6-13,15,20H,2,5,14H2,1H3,(H,23,25)