1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(3-ethylphenyl)thiourea

Systemtic Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(3-ethylphenyl)thiourea Openeye Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(3-ethylphenyl)thiourea CAS Name: 1-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-3-(3-ethylphenyl)thiourea IUPAC Name: 1-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-(3-ethylphenyl)thiourea Traditional Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(3-ethylphenyl)thiourea Formula: C21H24N4S MolecularWeight: 364.50706

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)NCC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)NCC2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H24N4S/c1-4-17-9-8-10-18(13-17)23-21(26)22-14-20-15(2)24-25(16(20)3)19-11-6-5-7-12-19/h5-13H,4,14H2,1-3H3,(H2,22,23,26)