1-(4-chloranyl-2-oxidanyl-phenyl)-3-[4-(2-dimethylaminoethyloxy)-3-(2-methylpyrazol-3-yl)phenyl]urea

Systemtic Name: 1-(4-chloranyl-2-oxidanyl-phenyl)-3-[4-(2-dimethylaminoethyloxy)-3-(2-methylpyrazol-3-yl)phenyl]urea Openeye Name: 1-(4-chloro-2-hydroxy-phenyl)-3-[4-(2-dimethylaminoethyloxy)-3-(2-methylpyrazol-3-yl)phenyl]urea CAS Name: 1-(4-chloro-2-hydroxyphenyl)-3-[4-(2-dimethylaminoethyloxy)-3-(2-methyl-3-pyrazolyl)phenyl]urea IUPAC Name: 1-(4-chloro-2-hydroxyphenyl)-3-[4-(2-dimethylaminoethyloxy)-3-(2-methylpyrazol-3-yl)phenyl]urea Traditional Name: 1-(4-chloro-2-hydroxy-phenyl)-3-[4-(2-dimethylaminoethyloxy)-3-(2-methylpyrazol-3-yl)phenyl]urea Formula: C21H24ClN5O3 MolecularWeight: 429.89996

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C2=C(C=CC(=C2)NC(=O)NC3=C(C=C(C=C3)Cl)O)OCCN(C)C

Isomeric SMILES

CN1C(=CC=N1)C2=C(C=CC(=C2)NC(=O)NC3=C(C=C(C=C3)Cl)O)OCCN(C)C

InChI

InChI=1S/C21H24ClN5O3/c1-26(2)10-11-30-20-7-5-15(13-16(20)18-8-9-23-27(18)3)24-21(29)25-17-6-4-14(22)12-19(17)28/h4-9,12-13,28H,10-11H2,1-3H3,(H2,24,25,29)