N-[6-(phenethylcarbamoylamino)-1,3-benzothiazol-2-yl]cyclohexanecarboxamide

Systemtic Name: N-[6-(phenethylcarbamoylamino)-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Openeye Name: N-[6-(phenethylcarbamoylamino)-1,3-benzothiazol-2-yl]cyclohexanecarboxamide CAS Name: N-[6-[[oxo-(phenethylamino)methyl]amino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide IUPAC Name: N-[6-(phenethylcarbamoylamino)-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Traditional Name: N-[6-(phenethylcarbamoylamino)-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Formula: C23H26N4O2S MolecularWeight: 422.54314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=C(C=C3)NC(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=C(C=C3)NC(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C23H26N4O2S/c28-21(17-9-5-2-6-10-17)27-23-26-19-12-11-18(15-20(19)30-23)25-22(29)24-14-13-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,15,17H,2,5-6,9-10,13-14H2,(H2,24,25,29)(H,26,27,28)