3-(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]propanamide

Systemtic Name: 3-(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]propanamide Openeye Name: 3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]propanamide CAS Name: 3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]propanamide IUPAC Name: 3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]propanamide Traditional Name: 3-(6-chloro-2-keto-1,3-benzoxazol-3-yl)-N-[2-(4-ethylbenzyl)pyrazol-3-yl]propionamide Formula: C22H21ClN4O3 MolecularWeight: 424.88014

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CCN3C4=C(C=C(C=C4)Cl)OC3=O

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CCN3C4=C(C=C(C=C4)Cl)OC3=O

InChI

InChI=1S/C22H21ClN4O3/c1-2-15-3-5-16(6-4-15)14-27-20(9-11-24-27)25-21(28)10-12-26-18-8-7-17(23)13-19(18)30-22(26)29/h3-9,11,13H,2,10,12,14H2,1H3,(H,25,28)