1-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)thiourea CAS Name: 1-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(1-benzyl-3,5-dimethylpyrazol-4-yl)thiourea Traditional Name: 1-benzyl-3-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)thiourea Formula: C20H22N4S MolecularWeight: 350.48048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)NC(=S)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)NC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4S/c1-15-19(22-20(25)21-13-17-9-5-3-6-10-17)16(2)24(23-15)14-18-11-7-4-8-12-18/h3-12H,13-14H2,1-2H3,(H2,21,22,25)