propan-2-yl 3-[4-(5-thiophen-2-ylpent-3-ynylamino)phenyl]propanoate

Systemtic Name: propan-2-yl 3-[4-(5-thiophen-2-ylpent-3-ynylamino)phenyl]propanoate Openeye Name: isopropyl 3-[4-[5-(2-thienyl)pent-3-ynylamino]phenyl]propanoate CAS Name: 3-[4-(5-thiophen-2-ylpent-3-ynylamino)phenyl]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[4-(5-thiophen-2-ylpent-3-ynylamino)phenyl]propanoate Traditional Name: 3-[4-[5-(2-thienyl)pent-3-ynylamino]phenyl]propionic acid isopropyl ester Formula: C21H25NO2S MolecularWeight: 355.4937

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CCC1=CC=C(C=C1)NCCC#CCC2=CC=CS2

Isomeric SMILES

CC(C)OC(=O)CCC1=CC=C(C=C1)NCCC#CCC2=CC=CS2

InChI

InChI=1S/C21H25NO2S/c1-17(2)24-21(23)14-11-18-9-12-19(13-10-18)22-15-5-3-4-7-20-8-6-16-25-20/h6,8-10,12-13,16-17,22H,5,7,11,14-15H2,1-2H3