1-[3-(4-bromanyl-3-methyl-pyrazol-1-yl)propyl]-3-(4-butylphenyl)thiourea

Systemtic Name: 1-[3-(4-bromanyl-3-methyl-pyrazol-1-yl)propyl]-3-(4-butylphenyl)thiourea Openeye Name: 1-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-3-(4-butylphenyl)thiourea CAS Name: 1-[3-(4-bromo-3-methyl-1-pyrazolyl)propyl]-3-(4-butylphenyl)thiourea IUPAC Name: 1-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-3-(4-butylphenyl)thiourea Traditional Name: 1-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-3-(4-butylphenyl)thiourea Formula: C18H25BrN4S MolecularWeight: 409.3869

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCCCN2C=C(C(=N2)C)Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCCCN2C=C(C(=N2)C)Br

InChI

InChI=1S/C18H25BrN4S/c1-3-4-6-15-7-9-16(10-8-15)21-18(24)20-11-5-12-23-13-17(19)14(2)22-23/h7-10,13H,3-6,11-12H2,1-2H3,(H2,20,21,24)