1-(2-oxidanylpropyl)-3-[[2-[(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)sulfanyl]phenyl]methyl]urea

Systemtic Name: 1-(2-oxidanylpropyl)-3-[[2-[(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)sulfanyl]phenyl]methyl]urea Openeye Name: 1-(2-hydroxypropyl)-3-[[2-[(3-isopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)sulfanyl]phenyl]methyl]urea CAS Name: 1-(2-hydroxypropyl)-3-[[2-[(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)thio]phenyl]methyl]urea IUPAC Name: 1-(2-hydroxypropyl)-3-[[2-[(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)sulfanyl]phenyl]methyl]urea Traditional Name: 1-(2-hydroxypropyl)-3-[2-[(3-isopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)thio]benzyl]urea Formula: C20H25N5O2S MolecularWeight: 399.5098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C2N1C=C(C=C2)SC3=CC=CC=C3CNC(=O)NCC(C)O

Isomeric SMILES

CC(C)C1=NN=C2N1C=C(C=C2)SC3=CC=CC=C3CNC(=O)NCC(C)O

InChI

InChI=1S/C20H25N5O2S/c1-13(2)19-24-23-18-9-8-16(12-25(18)19)28-17-7-5-4-6-15(17)11-22-20(27)21-10-14(3)26/h4-9,12-14,26H,10-11H2,1-3H3,(H2,21,22,27)