ethyl 3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophen-2-ylcarbonylamino)benzimidazol-1-yl]propanoate

Systemtic Name: ethyl 3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophen-2-ylcarbonylamino)benzimidazol-1-yl]propanoate Openeye Name: ethyl 3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propanoate CAS Name: 3-[5-[[cyclohexyl(methyl)amino]-oxomethyl]-2-[[oxo(thiophen-2-yl)methyl]amino]-1-benzimidazolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propanoate Traditional Name: 3-[5-[cyclohexyl(methyl)carbamoyl]-2-(2-thenoylamino)benzimidazol-1-yl]propionic acid ethyl ester Formula: C25H30N4O4S MolecularWeight: 482.5951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=C(C=C(C=C2)C(=O)N(C)C3CCCCC3)N=C1NC(=O)C4=CC=CS4

Isomeric SMILES

CCOC(=O)CCN1C2=C(C=C(C=C2)C(=O)N(C)C3CCCCC3)N=C1NC(=O)C4=CC=CS4

InChI

InChI=1S/C25H30N4O4S/c1-3-33-22(30)13-14-29-20-12-11-17(24(32)28(2)18-8-5-4-6-9-18)16-19(20)26-25(29)27-23(31)21-10-7-15-34-21/h7,10-12,15-16,18H,3-6,8-9,13-14H2,1-2H3,(H,26,27,31)