(2-phenyl-1,3-thiazol-4-yl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Openeye Name: (2-phenylthiazol-4-yl)methyl 4-[(isopropylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(isopropylcarbamoylamino)methyl]benzoic acid (2-phenylthiazol-4-yl)methyl ester Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OCC2=CSC(=N2)C3=CC=CC=C3

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OCC2=CSC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C22H23N3O3S/c1-15(2)24-22(27)23-12-16-8-10-18(11-9-16)21(26)28-13-19-14-29-20(25-19)17-6-4-3-5-7-17/h3-11,14-15H,12-13H2,1-2H3,(H2,23,24,27)