N-(4-ethoxyphenyl)-5-[[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]amino]-1H-pyrazole-4-carboxamide

Systemtic Name: N-(4-ethoxyphenyl)-5-[[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]amino]-1H-pyrazole-4-carboxamide Openeye Name: 5-[[2-(benzylamino)-2-oxo-ethyl]amino]-N-(4-ethoxyphenyl)-1H-pyrazole-4-carboxamide CAS Name: N-(4-ethoxyphenyl)-5-[[2-oxo-2-[(phenylmethyl)amino]ethyl]amino]-1H-pyrazole-4-carboxamide IUPAC Name: 5-[[2-(benzylamino)-2-oxoethyl]amino]-N-(4-ethoxyphenyl)-1H-pyrazole-4-carboxamide Traditional Name: 5-[[2-(benzylamino)-2-keto-ethyl]amino]-N-p-phenetyl-1H-pyrazole-4-carboxamide Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=C(NN=C2)NCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=C(NN=C2)NCC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H23N5O3/c1-2-29-17-10-8-16(9-11-17)25-21(28)18-13-24-26-20(18)23-14-19(27)22-12-15-6-4-3-5-7-15/h3-11,13H,2,12,14H2,1H3,(H,22,27)(H,25,28)(H2,23,24,26)