3-(4-ethylphenyl)-1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]thiourea

Systemtic Name: 3-(4-ethylphenyl)-1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]thiourea Openeye Name: 3-(4-ethylphenyl)-1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]thiourea CAS Name: 3-(4-ethylphenyl)-1-methyl-1-[(1-phenyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 3-(4-ethylphenyl)-1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]thiourea Traditional Name: 3-(4-ethylphenyl)-1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]thiourea Formula: C20H22N4S MolecularWeight: 350.48048

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)N(C)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)N(C)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4S/c1-3-16-9-11-18(12-10-16)22-20(25)23(2)14-17-13-21-24(15-17)19-7-5-4-6-8-19/h4-13,15H,3,14H2,1-2H3,(H,22,25)