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

Systemtic Name: 1-[3-(4-bromanyl-3-methyl-pyrazol-1-yl)propyl]-3-[(4-methylphenyl)methyl]thiourea Openeye Name: 1-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-3-(p-tolylmethyl)thiourea CAS Name: 1-[3-(4-bromo-3-methyl-1-pyrazolyl)propyl]-3-[(4-methylphenyl)methyl]thiourea IUPAC Name: 1-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-3-[(4-methylphenyl)methyl]thiourea Traditional Name: 1-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-3-(4-methylbenzyl)thiourea Formula: C16H21BrN4S MolecularWeight: 381.33374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=S)NCCCN2C=C(C(=N2)C)Br

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=S)NCCCN2C=C(C(=N2)C)Br

InChI

InChI=1S/C16H21BrN4S/c1-12-4-6-14(7-5-12)10-19-16(22)18-8-3-9-21-11-15(17)13(2)20-21/h4-7,11H,3,8-10H2,1-2H3,(H2,18,19,22)