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

Systemtic Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-[(phenylmethyl)carbamoylamino]ethanamide Openeye Name: 2-(benzylcarbamoylamino)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)acetamide CAS Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-2-[[oxo-[(phenylmethyl)amino]methyl]amino]acetamide IUPAC Name: 2-(benzylcarbamoylamino)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)acetamide Traditional Name: 2-(benzylcarbamoylamino)-N-[2-(methylthio)-1,3-benzothiazol-6-yl]acetamide Formula: C18H18N4O2S2 MolecularWeight: 386.49112

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CNC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CNC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C18H18N4O2S2/c1-25-18-22-14-8-7-13(9-15(14)26-18)21-16(23)11-20-17(24)19-10-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H,21,23)(H2,19,20,24)