1-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-3-(2-ethylphenyl)thiourea

Systemtic Name: 1-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-3-(2-ethylphenyl)thiourea Openeye Name: 1-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-3-(2-ethylphenyl)thiourea CAS Name: 1-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propyl]-3-(2-ethylphenyl)thiourea IUPAC Name: 1-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]-3-(2-ethylphenyl)thiourea Traditional Name: 1-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-3-(2-ethylphenyl)thiourea Formula: C17H23BrN4S MolecularWeight: 395.36032

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)NCCCN2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)NCCCN2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C17H23BrN4S/c1-4-14-8-5-6-9-15(14)20-17(23)19-10-7-11-22-13(3)16(18)12(2)21-22/h5-6,8-9H,4,7,10-11H2,1-3H3,(H2,19,20,23)