1-(4-butan-2-ylphenyl)-3-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]thiourea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]thiourea Openeye Name: 1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-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)NCC2=C(N(N=C2C)CC)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)NCC2=C(N(N=C2C)CC)C

InChI

InChI=1S/C19H28N4S/c1-6-13(3)16-8-10-17(11-9-16)21-19(24)20-12-18-14(4)22-23(7-2)15(18)5/h8-11,13H,6-7,12H2,1-5H3,(H2,20,21,24)