1-(4-bromanyl-3-methyl-phenyl)-3-(5-piperidin-1-yl-1,3,4-thiadiazol-2-yl)urea

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-3-(5-piperidin-1-yl-1,3,4-thiadiazol-2-yl)urea Openeye Name: 1-(4-bromo-3-methyl-phenyl)-3-[5-(1-piperidyl)-1,3,4-thiadiazol-2-yl]urea CAS Name: 1-(4-bromo-3-methylphenyl)-3-[5-(1-piperidinyl)-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-(4-bromo-3-methylphenyl)-3-(5-piperidin-1-yl-1,3,4-thiadiazol-2-yl)urea Traditional Name: 1-(4-bromo-3-methyl-phenyl)-3-(5-piperidino-1,3,4-thiadiazol-2-yl)urea Formula: C15H18BrN5OS MolecularWeight: 396.30532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)NC2=NN=C(S2)N3CCCCC3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)NC2=NN=C(S2)N3CCCCC3)Br

InChI

InChI=1S/C15H18BrN5OS/c1-10-9-11(5-6-12(10)16)17-13(22)18-14-19-20-15(23-14)21-7-3-2-4-8-21/h5-6,9H,2-4,7-8H2,1H3,(H2,17,18,19,22)