(E)-3-azanyl-6-(4-cyclopropyl-1,3-thiazol-2-yl)-2-ethyl-4-oxidanylidene-3-phenyl-2-propyl-hex-5-enoic acid

Systemtic Name: (E)-3-azanyl-6-(4-cyclopropyl-1,3-thiazol-2-yl)-2-ethyl-4-oxidanylidene-3-phenyl-2-propyl-hex-5-enoic acid Openeye Name: (E)-3-amino-6-(4-cyclopropylthiazol-2-yl)-2-ethyl-4-oxo-3-phenyl-2-propyl-hex-5-enoic acid CAS Name: (E)-3-amino-6-(4-cyclopropyl-2-thiazolyl)-2-ethyl-4-oxo-3-phenyl-2-propyl-5-hexenoic acid IUPAC Name: (E)-3-amino-6-(4-cyclopropyl-1,3-thiazol-2-yl)-2-ethyl-4-oxo-3-phenyl-2-propylhex-5-enoic acid Traditional Name: (E)-3-amino-6-(4-cyclopropylthiazol-2-yl)-2-ethyl-4-keto-3-phenyl-2-propyl-hex-5-enoic acid Formula: C23H28N2O3S MolecularWeight: 412.54502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)(C(=O)O)C(C1=CC=CC=C1)(C(=O)C=CC2=NC(=CS2)C3CC3)N

Isomeric SMILES

CCCC(CC)(C(=O)O)C(C1=CC=CC=C1)(C(=O)/C=C/C2=NC(=CS2)C3CC3)N

InChI

InChI=1S/C23H28N2O3S/c1-3-14-22(4-2,21(27)28)23(24,17-8-6-5-7-9-17)19(26)12-13-20-25-18(15-29-20)16-10-11-16/h5-9,12-13,15-16H,3-4,10-11,14,24H2,1-2H3,(H,27,28)/b13-12+