methyl 4-methyl-2-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)carbamoylamino]pentanoate

Systemtic Name: methyl 4-methyl-2-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)carbamoylamino]pentanoate Openeye Name: methyl 4-methyl-2-[[2-(4-pyridyl)-1,3-benzoxazol-5-yl]carbamoylamino]pentanoate CAS Name: 4-methyl-2-[[oxo-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)amino]methyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 4-methyl-2-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)carbamoylamino]pentanoate Traditional Name: 4-methyl-2-[[2-(4-pyridyl)-1,3-benzoxazol-5-yl]carbamoylamino]valeric acid methyl ester Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)NC1=CC2=C(C=C1)OC(=N2)C3=CC=NC=C3

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)NC1=CC2=C(C=C1)OC(=N2)C3=CC=NC=C3

InChI

InChI=1S/C20H22N4O4/c1-12(2)10-16(19(25)27-3)24-20(26)22-14-4-5-17-15(11-14)23-18(28-17)13-6-8-21-9-7-13/h4-9,11-12,16H,10H2,1-3H3,(H2,22,24,26)