N-[3-(aminocarbonylamino)phenyl]-1-(3-chloranyl-4-methyl-phenyl)-5-cyclopropyl-pyrazole-4-carboxamide

Systemtic Name: N-[3-(aminocarbonylamino)phenyl]-1-(3-chloranyl-4-methyl-phenyl)-5-cyclopropyl-pyrazole-4-carboxamide Openeye Name: 1-(3-chloro-4-methyl-phenyl)-5-cyclopropyl-N-(3-ureidophenyl)pyrazole-4-carboxamide CAS Name: N-[3-(carbamoylamino)phenyl]-1-(3-chloro-4-methylphenyl)-5-cyclopropyl-4-pyrazolecarboxamide IUPAC Name: N-[3-(carbamoylamino)phenyl]-1-(3-chloro-4-methylphenyl)-5-cyclopropylpyrazole-4-carboxamide Traditional Name: 1-(3-chloro-4-methyl-phenyl)-5-cyclopropyl-N-(3-ureidophenyl)pyrazole-4-carboxamide Formula: C21H20ClN5O2 MolecularWeight: 409.8688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC(=CC=C3)NC(=O)N)C4CC4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC(=CC=C3)NC(=O)N)C4CC4)Cl

InChI

InChI=1S/C21H20ClN5O2/c1-12-5-8-16(10-18(12)22)27-19(13-6-7-13)17(11-24-27)20(28)25-14-3-2-4-15(9-14)26-21(23)29/h2-5,8-11,13H,6-7H2,1H3,(H,25,28)(H3,23,26,29)