1-(5-bromanylpyridin-2-yl)-3-[3-(2-methoxyphenyl)-3-oxidanylidene-propyl]thiourea

Systemtic Name: 1-(5-bromanylpyridin-2-yl)-3-[3-(2-methoxyphenyl)-3-oxidanylidene-propyl]thiourea Openeye Name: 1-(5-bromo-2-pyridyl)-3-[3-(2-methoxyphenyl)-3-oxo-propyl]thiourea CAS Name: 1-(5-bromo-2-pyridinyl)-3-[3-(2-methoxyphenyl)-3-oxopropyl]thiourea IUPAC Name: 1-(5-bromopyridin-2-yl)-3-[3-(2-methoxyphenyl)-3-oxopropyl]thiourea Traditional Name: 1-(5-bromo-2-pyridyl)-3-[3-keto-3-(2-methoxyphenyl)propyl]thiourea Formula: C16H16BrN3O2S MolecularWeight: 394.28614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)CCNC(=S)NC2=NC=C(C=C2)Br

Isomeric SMILES

COC1=CC=CC=C1C(=O)CCNC(=S)NC2=NC=C(C=C2)Br

InChI

InChI=1S/C16H16BrN3O2S/c1-22-14-5-3-2-4-12(14)13(21)8-9-18-16(23)20-15-7-6-11(17)10-19-15/h2-7,10H,8-9H2,1H3,(H2,18,19,20,23)