1-(5-chloranyl-2-methoxy-phenyl)-3-(3,3-dimethyl-1-pyrazol-1-yl-butan-2-yl)thiourea

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-(3,3-dimethyl-1-pyrazol-1-yl-butan-2-yl)thiourea Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-3-[2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]thiourea CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-[3,3-dimethyl-1-(1-pyrazolyl)butan-2-yl]thiourea IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-3-(3,3-dimethyl-1-pyrazol-1-ylbutan-2-yl)thiourea Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-3-[2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]thiourea Formula: C17H23ClN4OS MolecularWeight: 366.90872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1C=CC=N1)NC(=S)NC2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CC(C)(C)C(CN1C=CC=N1)NC(=S)NC2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C17H23ClN4OS/c1-17(2,3)15(11-22-9-5-8-19-22)21-16(24)20-13-10-12(18)6-7-14(13)23-4/h5-10,15H,11H2,1-4H3,(H2,20,21,24)