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

Systemtic Name: 3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-(2-hydroxyethyl)-1-phenyl-thiourea Openeye Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-1-(2-hydroxyethyl)-1-phenyl-thiourea CAS Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-1-(2-hydroxyethyl)-1-phenylthiourea IUPAC Name: 3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1-(2-hydroxyethyl)-1-phenylthiourea Traditional Name: 1-(2-hydroxyethyl)-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-1-phenyl-thiourea Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O2S/c1-15-18(19(26)24(22(15)2)17-11-7-4-8-12-17)21-20(27)23(13-14-25)16-9-5-3-6-10-16/h3-12,25H,13-14H2,1-2H3,(H,21,27)