N,5-bis(2-azanyl-3-phenyl-propanoyl)-4-cyano-N-pyrrolidin-2-ylcarbonyl-1,3-thiazole-2-carboxamide

Systemtic Name: N,5-bis(2-azanyl-3-phenyl-propanoyl)-4-cyano-N-pyrrolidin-2-ylcarbonyl-1,3-thiazole-2-carboxamide Openeye Name: N,5-bis(2-amino-3-phenyl-propanoyl)-4-cyano-N-(pyrrolidine-2-carbonyl)thiazole-2-carboxamide CAS Name: N,5-bis(2-amino-1-oxo-3-phenylpropyl)-4-cyano-N-[oxo(2-pyrrolidinyl)methyl]-2-thiazolecarboxamide IUPAC Name: N,5-bis(2-amino-3-phenylpropanoyl)-4-cyano-N-(pyrrolidine-2-carbonyl)-1,3-thiazole-2-carboxamide Traditional Name: 4-cyano-N,5-diphenylalanyl-N-prolyl-thiazole-2-carboxamide Formula: C28H28N6O4S MolecularWeight: 544.62472

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)N(C(=O)C2=NC(=C(S2)C(=O)C(CC3=CC=CC=C3)N)C#N)C(=O)C(CC4=CC=CC=C4)N

Isomeric SMILES

C1CC(NC1)C(=O)N(C(=O)C2=NC(=C(S2)C(=O)C(CC3=CC=CC=C3)N)C#N)C(=O)C(CC4=CC=CC=C4)N

InChI

InChI=1S/C28H28N6O4S/c29-16-22-24(23(35)19(30)14-17-8-3-1-4-9-17)39-25(33-22)28(38)34(27(37)21-12-7-13-32-21)26(36)20(31)15-18-10-5-2-6-11-18/h1-6,8-11,19-21,32H,7,12-15,30-31H2