1-(3-chloranyl-4-methyl-phenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[1-(1-naphthylmethyl)pyrazol-4-yl]thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[1-(1-naphthalenylmethyl)-4-pyrazolyl]thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[1-(1-naphthylmethyl)pyrazol-4-yl]thiourea Formula: C22H19ClN4S MolecularWeight: 406.93106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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