1-(3-chloranyl-2-methyl-phenyl)-3-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[(1,3,5-trimethyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea Formula: C15H19ClN4S MolecularWeight: 322.85616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NCC2=C(N(N=C2C)C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NCC2=C(N(N=C2C)C)C

InChI

InChI=1S/C15H19ClN4S/c1-9-13(16)6-5-7-14(9)18-15(21)17-8-12-10(2)19-20(4)11(12)3/h5-7H,8H2,1-4H3,(H2,17,18,21)