propan-2-yl 2-[2-[5-(thiophen-2-ylcarbonylamino)pentyl]benzimidazol-1-yl]ethanoate

Systemtic Name: propan-2-yl 2-[2-[5-(thiophen-2-ylcarbonylamino)pentyl]benzimidazol-1-yl]ethanoate Openeye Name: isopropyl 2-[2-[5-(thiophene-2-carbonylamino)pentyl]benzimidazol-1-yl]acetate CAS Name: 2-[2-[5-[[oxo(thiophen-2-yl)methyl]amino]pentyl]-1-benzimidazolyl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[2-[5-(thiophene-2-carbonylamino)pentyl]benzimidazol-1-yl]acetate Traditional Name: 2-[2-[5-(2-thenoylamino)pentyl]benzimidazol-1-yl]acetic acid isopropyl ester Formula: C22H27N3O3S MolecularWeight: 413.53308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CN1C2=CC=CC=C2N=C1CCCCCNC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)OC(=O)CN1C2=CC=CC=C2N=C1CCCCCNC(=O)C3=CC=CS3

InChI

InChI=1S/C22H27N3O3S/c1-16(2)28-21(26)15-25-18-10-6-5-9-17(18)24-20(25)12-4-3-7-13-23-22(27)19-11-8-14-29-19/h5-6,8-11,14,16H,3-4,7,12-13,15H2,1-2H3,(H,23,27)