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

Systemtic Name: 1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(5-oxidanylnaphthalen-1-yl)thiourea Openeye Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-(5-hydroxy-1-naphthyl)thiourea CAS Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-(5-hydroxy-1-naphthalenyl)thiourea IUPAC Name: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(5-hydroxynaphthalen-1-yl)thiourea Traditional Name: 1-(5-hydroxy-1-naphthyl)-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)thiourea Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NC3=CC=CC4=C3C=CC=C4O

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NC3=CC=CC4=C3C=CC=C4O

InChI

InChI=1S/C22H20N4O2S/c1-14-20(21(28)26(25(14)2)15-8-4-3-5-9-15)24-22(29)23-18-12-6-11-17-16(18)10-7-13-19(17)27/h3-13,27H,1-2H3,(H2,23,24,29)