1-(4-butan-2-ylphenyl)-3-[3-(3,5-dimethylpyrazol-1-yl)propyl]thiourea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-[3-(3,5-dimethylpyrazol-1-yl)propyl]thiourea Openeye Name: 1-[3-(3,5-dimethylpyrazol-1-yl)propyl]-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-[3-(3,5-dimethyl-1-pyrazolyl)propyl]thiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-[3-(3,5-dimethylpyrazol-1-yl)propyl]thiourea Traditional Name: 1-[3-(3,5-dimethylpyrazol-1-yl)propyl]-3-(4-sec-butylphenyl)thiourea Formula: C19H28N4S MolecularWeight: 344.51742

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)NCCCN2C(=CC(=N2)C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)NCCCN2C(=CC(=N2)C)C

InChI

InChI=1S/C19H28N4S/c1-5-14(2)17-7-9-18(10-8-17)21-19(24)20-11-6-12-23-16(4)13-15(3)22-23/h7-10,13-14H,5-6,11-12H2,1-4H3,(H2,20,21,24)