1-(4-butylphenyl)-3-[3-(4-chloranyl-5-methyl-pyrazol-1-yl)propyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[3-(4-chloranyl-5-methyl-pyrazol-1-yl)propyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[3-(4-chloro-5-methyl-pyrazol-1-yl)propyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[3-(4-chloro-5-methyl-1-pyrazolyl)propyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[3-(4-chloro-5-methylpyrazol-1-yl)propyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-[3-(4-chloro-5-methyl-pyrazol-1-yl)propyl]thiourea Formula: C18H25ClN4S MolecularWeight: 364.9359

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25ClN4S/c1-3-4-6-15-7-9-16(10-8-15)22-18(24)20-11-5-12-23-14(2)17(19)13-21-23/h7-10,13H,3-6,11-12H2,1-2H3,(H2,20,22,24)