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

Systemtic Name: 1-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-3-(2-methoxy-5-methyl-phenyl)thiourea Openeye Name: 1-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-3-(2-methoxy-5-methyl-phenyl)thiourea CAS Name: 1-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propyl]-3-(2-methoxy-5-methylphenyl)thiourea IUPAC Name: 1-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]-3-(2-methoxy-5-methylphenyl)thiourea Traditional Name: 1-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-3-(2-methoxy-5-methyl-phenyl)thiourea Formula: C17H23BrN4OS MolecularWeight: 411.35972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)NCCCN2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)NCCCN2C(=C(C(=N2)C)Br)C

InChI

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