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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N(C)CC2=C(N(N=C2C)C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N(C)CC2=C(N(N=C2C)C)C)Cl

InChI

InChI=1S/C16H21ClN4S/c1-10-6-7-13(8-15(10)17)18-16(22)20(4)9-14-11(2)19-21(5)12(14)3/h6-8H,9H2,1-5H3,(H,18,22)