(E)-2-azanyl-5-(4-cyclobutyl-1,3-thiazol-2-yl)-2-cyclohexyl-3-methanoyl-3-phenyl-pent-4-enoic acid

Systemtic Name: (E)-2-azanyl-5-(4-cyclobutyl-1,3-thiazol-2-yl)-2-cyclohexyl-3-methanoyl-3-phenyl-pent-4-enoic acid Openeye Name: (E)-2-amino-5-(4-cyclobutylthiazol-2-yl)-2-cyclohexyl-3-formyl-3-phenyl-pent-4-enoic acid CAS Name: (E)-2-amino-5-(4-cyclobutyl-2-thiazolyl)-2-cyclohexyl-3-formyl-3-phenyl-4-pentenoic acid IUPAC Name: (E)-2-amino-5-(4-cyclobutyl-1,3-thiazol-2-yl)-2-cyclohexyl-3-formyl-3-phenylpent-4-enoic acid Traditional Name: (E)-2-amino-5-(4-cyclobutylthiazol-2-yl)-2-cyclohexyl-3-formyl-3-phenyl-pent-4-enoic acid Formula: C25H30N2O3S MolecularWeight: 438.5823

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(=O)O)(C(C=CC2=NC(=CS2)C3CCC3)(C=O)C4=CC=CC=C4)N

Isomeric SMILES

C1CCC(CC1)C(C(=O)O)(C(/C=C/C2=NC(=CS2)C3CCC3)(C=O)C4=CC=CC=C4)N

InChI

InChI=1S/C25H30N2O3S/c26-25(23(29)30,20-12-5-2-6-13-20)24(17-28,19-10-3-1-4-11-19)15-14-22-27-21(16-31-22)18-8-7-9-18/h1,3-4,10-11,14-18,20H,2,5-9,12-13,26H2,(H,29,30)/b15-14+