1-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]-3-propan-2-yl-thiourea

Systemtic Name: 1-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]-3-propan-2-yl-thiourea Openeye Name: 1-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]-3-isopropyl-thiourea CAS Name: 1-[[3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-oxopropyl]amino]-3-propan-2-ylthiourea IUPAC Name: 1-[3-(3,5-dimethyl-1-phenylpyrazol-4-yl)propanoylamino]-3-propan-2-ylthiourea Traditional Name: 1-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]-3-isopropyl-thiourea Formula: C18H25N5OS MolecularWeight: 359.489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)NNC(=S)NC(C)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)NNC(=S)NC(C)C

InChI

InChI=1S/C18H25N5OS/c1-12(2)19-18(25)21-20-17(24)11-10-16-13(3)22-23(14(16)4)15-8-6-5-7-9-15/h5-9,12H,10-11H2,1-4H3,(H,20,24)(H2,19,21,25)