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

Systemtic Name: 1-[3,5-dimethyl-1-(naphthalen-1-ylmethyl)pyrazol-4-yl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[3,5-dimethyl-1-(1-naphthylmethyl)pyrazol-4-yl]thiourea CAS Name: 1-[3,5-dimethyl-1-(1-naphthalenylmethyl)-4-pyrazolyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[3,5-dimethyl-1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea Traditional Name: 1-benzyl-3-[3,5-dimethyl-1-(1-naphthylmethyl)pyrazol-4-yl]thiourea Formula: C24H24N4S MolecularWeight: 400.53916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC3=CC=CC=C32)C)NC(=S)NCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC3=CC=CC=C32)C)NC(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C24H24N4S/c1-17-23(26-24(29)25-15-19-9-4-3-5-10-19)18(2)28(27-17)16-21-13-8-12-20-11-6-7-14-22(20)21/h3-14H,15-16H2,1-2H3,(H2,25,26,29)