(phenylmethyl) N-[3-(4-nitrophenyl)-1-oxidanylidene-1-(1,3-thiazol-2-ylamino)propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[3-(4-nitrophenyl)-1-oxidanylidene-1-(1,3-thiazol-2-ylamino)propan-2-yl]carbamate Openeye Name: benzyl N-[1-[(4-nitrophenyl)methyl]-2-oxo-2-(thiazol-2-ylamino)ethyl]carbamate CAS Name: N-[3-(4-nitrophenyl)-1-oxo-1-(2-thiazolylamino)propan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-(4-nitrophenyl)-1-oxo-1-(1,3-thiazol-2-ylamino)propan-2-yl]carbamate Traditional Name: N-[2-keto-1-(4-nitrobenzyl)-2-(thiazol-2-ylamino)ethyl]carbamic acid benzyl ester Formula: C20H18N4O5S MolecularWeight: 426.44572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=NC=CS3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=NC=CS3

InChI

InChI=1S/C20H18N4O5S/c25-18(23-19-21-10-11-30-19)17(12-14-6-8-16(9-7-14)24(27)28)22-20(26)29-13-15-4-2-1-3-5-15/h1-11,17H,12-13H2,(H,22,26)(H,21,23,25)