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

Systemtic Name: 1-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-3-(4-ethoxyphenyl)thiourea Openeye Name: 1-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-3-(4-ethoxyphenyl)thiourea CAS Name: 1-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propyl]-3-(4-ethoxyphenyl)thiourea IUPAC Name: 1-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]-3-(4-ethoxyphenyl)thiourea Traditional Name: 1-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-3-p-phenetyl-thiourea Formula: C17H23BrN4OS MolecularWeight: 411.35972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NCCCN2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NCCCN2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C17H23BrN4OS/c1-4-23-15-8-6-14(7-9-15)20-17(24)19-10-5-11-22-13(3)16(18)12(2)21-22/h6-9H,4-5,10-11H2,1-3H3,(H2,19,20,24)