1-[(5-bromanylpyridin-3-yl)carbonylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea

Systemtic Name: 1-[(5-bromanylpyridin-3-yl)carbonylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea Openeye Name: 1-[(5-bromopyridine-3-carbonyl)amino]-3-(2-ethyl-6-methyl-phenyl)thiourea CAS Name: 1-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-[(5-bromopyridine-3-carbonyl)amino]-3-(2-ethyl-6-methylphenyl)thiourea Traditional Name: 1-[(5-bromonicotinoyl)amino]-3-(2-ethyl-6-methyl-phenyl)thiourea Formula: C16H17BrN4OS MolecularWeight: 393.30138

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=CC(=CN=C2)Br)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=CC(=CN=C2)Br)C

InChI

InChI=1S/C16H17BrN4OS/c1-3-11-6-4-5-10(2)14(11)19-16(23)21-20-15(22)12-7-13(17)9-18-8-12/h4-9H,3H2,1-2H3,(H,20,22)(H2,19,21,23)