3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-phenyl-1-propan-2-yl-thiourea

Systemtic Name: 3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-phenyl-1-propan-2-yl-thiourea Openeye Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-1-isopropyl-1-phenyl-thiourea CAS Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-1-phenyl-1-propan-2-ylthiourea IUPAC Name: 3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1-phenyl-1-propan-2-ylthiourea Traditional Name: 1-isopropyl-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-1-phenyl-thiourea Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)N(C3=CC=CC=C3)C(C)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)N(C3=CC=CC=C3)C(C)C

InChI

InChI=1S/C21H24N4OS/c1-15(2)24(17-11-7-5-8-12-17)21(27)22-19-16(3)23(4)25(20(19)26)18-13-9-6-10-14-18/h5-15H,1-4H3,(H,22,27)