1-(2-methoxy-5-methyl-phenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea

Systemtic Name: 1-(2-methoxy-5-methyl-phenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea Openeye Name: 1-(2-methoxy-5-methyl-phenyl)-3-[1-(1-naphthylmethyl)pyrazol-4-yl]thiourea CAS Name: 1-(2-methoxy-5-methylphenyl)-3-[1-(1-naphthalenylmethyl)-4-pyrazolyl]thiourea IUPAC Name: 1-(2-methoxy-5-methylphenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea Traditional Name: 1-(2-methoxy-5-methyl-phenyl)-3-[1-(1-naphthylmethyl)pyrazol-4-yl]thiourea Formula: C23H22N4OS MolecularWeight: 402.51198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N4OS/c1-16-10-11-22(28-2)21(12-16)26-23(29)25-19-13-24-27(15-19)14-18-8-5-7-17-6-3-4-9-20(17)18/h3-13,15H,14H2,1-2H3,(H2,25,26,29)