1-[3-(4-bromanyl-3-methyl-pyrazol-1-yl)propyl]-3-(3,5-dimethoxyphenyl)thiourea

Systemtic Name: 1-[3-(4-bromanyl-3-methyl-pyrazol-1-yl)propyl]-3-(3,5-dimethoxyphenyl)thiourea Openeye Name: 1-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-3-(3,5-dimethoxyphenyl)thiourea CAS Name: 1-[3-(4-bromo-3-methyl-1-pyrazolyl)propyl]-3-(3,5-dimethoxyphenyl)thiourea IUPAC Name: 1-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-3-(3,5-dimethoxyphenyl)thiourea Traditional Name: 1-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-3-(3,5-dimethoxyphenyl)thiourea Formula: C16H21BrN4O2S MolecularWeight: 413.33254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1Br)CCCNC(=S)NC2=CC(=CC(=C2)OC)OC

Isomeric SMILES

CC1=NN(C=C1Br)CCCNC(=S)NC2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C16H21BrN4O2S/c1-11-15(17)10-21(20-11)6-4-5-18-16(24)19-12-7-13(22-2)9-14(8-12)23-3/h7-10H,4-6H2,1-3H3,(H2,18,19,24)