N-(2-acetamido-1,3-benzothiazol-6-yl)-2-[(phenylmethyl)carbamoylamino]ethanamide

Systemtic Name: N-(2-acetamido-1,3-benzothiazol-6-yl)-2-[(phenylmethyl)carbamoylamino]ethanamide Openeye Name: N-(2-acetamido-1,3-benzothiazol-6-yl)-2-(benzylcarbamoylamino)acetamide CAS Name: N-(2-acetamido-1,3-benzothiazol-6-yl)-2-[[oxo-[(phenylmethyl)amino]methyl]amino]acetamide IUPAC Name: N-(2-acetamido-1,3-benzothiazol-6-yl)-2-(benzylcarbamoylamino)acetamide Traditional Name: N-(2-acetamido-1,3-benzothiazol-6-yl)-2-(benzylcarbamoylamino)acetamide Formula: C19H19N5O3S MolecularWeight: 397.45086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)CNC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)CNC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C19H19N5O3S/c1-12(25)22-19-24-15-8-7-14(9-16(15)28-19)23-17(26)11-21-18(27)20-10-13-5-3-2-4-6-13/h2-9H,10-11H2,1H3,(H,23,26)(H2,20,21,27)(H,22,24,25)