1-(3-chloranyl-4-methyl-phenyl)-3-[3-(3,5-dimethylpyrazol-1-yl)propyl]thiourea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[3-(3,5-dimethylpyrazol-1-yl)propyl]thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[3-(3,5-dimethylpyrazol-1-yl)propyl]thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[3-(3,5-dimethyl-1-pyrazolyl)propyl]thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[3-(3,5-dimethylpyrazol-1-yl)propyl]thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[3-(3,5-dimethylpyrazol-1-yl)propyl]thiourea Formula: C16H21ClN4S MolecularWeight: 336.88274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCCCN2C(=CC(=N2)C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCCCN2C(=CC(=N2)C)C)Cl

InChI

InChI=1S/C16H21ClN4S/c1-11-5-6-14(10-15(11)17)19-16(22)18-7-4-8-21-13(3)9-12(2)20-21/h5-6,9-10H,4,7-8H2,1-3H3,(H2,18,19,22)