1-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-3-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-(1-benzyl-4-chloro-pyrazol-3-yl)-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[4-chloro-1-(phenylmethyl)-3-pyrazolyl]-3-(2-oxolanylmethyl)thiourea IUPAC Name: 1-(1-benzyl-4-chloropyrazol-3-yl)-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-(1-benzyl-4-chloro-pyrazol-3-yl)-3-(tetrahydrofurfuryl)thiourea Formula: C16H19ClN4OS MolecularWeight: 350.86626

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)NC2=NN(C=C2Cl)CC3=CC=CC=C3

Isomeric SMILES

C1CC(OC1)CNC(=S)NC2=NN(C=C2Cl)CC3=CC=CC=C3

InChI

InChI=1S/C16H19ClN4OS/c17-14-11-21(10-12-5-2-1-3-6-12)20-15(14)19-16(23)18-9-13-7-4-8-22-13/h1-3,5-6,11,13H,4,7-10H2,(H2,18,19,20,23)