1-[3-(4-bromanylpyrazol-1-yl)propyl]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea

Systemtic Name: 1-[3-(4-bromanylpyrazol-1-yl)propyl]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Openeye Name: 1-[3-(4-bromopyrazol-1-yl)propyl]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea CAS Name: 1-[3-(4-bromo-1-pyrazolyl)propyl]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea IUPAC Name: 1-[3-(4-bromopyrazol-1-yl)propyl]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Traditional Name: 1-[3-(4-bromopyrazol-1-yl)propyl]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Formula: C15H17BrN4O2S MolecularWeight: 397.29008

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=S)NCCCN3C=C(C=N3)Br

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=S)NCCCN3C=C(C=N3)Br

InChI

InChI=1S/C15H17BrN4O2S/c16-11-9-18-20(10-11)5-1-4-17-15(23)19-12-2-3-13-14(8-12)22-7-6-21-13/h2-3,8-10H,1,4-7H2,(H2,17,19,23)