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

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]thiourea Openeye Name: 1-(5-chloro-2-methyl-phenyl)-3-[1-(1-naphthylmethyl)pyrazol-3-yl]thiourea CAS Name: 1-(5-chloro-2-methylphenyl)-3-[1-(1-naphthalenylmethyl)-3-pyrazolyl]thiourea IUPAC Name: 1-(5-chloro-2-methylphenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]thiourea Traditional Name: 1-(5-chloro-2-methyl-phenyl)-3-[1-(1-naphthylmethyl)pyrazol-3-yl]thiourea Formula: C22H19ClN4S MolecularWeight: 406.93106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=S)NC2=NN(C=C2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=S)NC2=NN(C=C2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H19ClN4S/c1-15-9-10-18(23)13-20(15)24-22(28)25-21-11-12-27(26-21)14-17-7-4-6-16-5-2-3-8-19(16)17/h2-13H,14H2,1H3,(H2,24,25,26,28)