1-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-3-(2-methoxyphenyl)thiourea

Systemtic Name: 1-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-3-(2-methoxyphenyl)thiourea Openeye Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-(2-methoxyphenyl)thiourea CAS Name: 1-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-3-(2-methoxyphenyl)thiourea IUPAC Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-(2-methoxyphenyl)thiourea Traditional Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-(2-methoxyphenyl)thiourea Formula: C18H17BrN4OS MolecularWeight: 417.32278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=S)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

Isomeric SMILES

COC1=CC=CC=C1NC(=S)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

InChI

InChI=1S/C18H17BrN4OS/c1-24-17-8-3-2-7-16(17)22-18(25)21-15-6-4-5-13(9-15)11-23-12-14(19)10-20-23/h2-10,12H,11H2,1H3,(H2,21,22,25)