1-(3,5-dimethylphenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-[1-(1-naphthylmethyl)pyrazol-4-yl]thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-[1-(1-naphthalenylmethyl)-4-pyrazolyl]thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-[1-(1-naphthylmethyl)pyrazol-4-yl]thiourea Formula: C23H22N4S MolecularWeight: 386.51258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NC2=CN(N=C2)CC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NC2=CN(N=C2)CC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C23H22N4S/c1-16-10-17(2)12-20(11-16)25-23(28)26-21-13-24-27(15-21)14-19-8-5-7-18-6-3-4-9-22(18)19/h3-13,15H,14H2,1-2H3,(H2,25,26,28)