2-azanyl-N-[1-[2-methanoyl-1-(phenylmethyl)sulfonyl-pyrrolidin-2-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]-3-phenyl-propanamide

Systemtic Name: 2-azanyl-N-[1-[2-methanoyl-1-(phenylmethyl)sulfonyl-pyrrolidin-2-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]-3-phenyl-propanamide Openeye Name: 2-amino-N-[1-benzyl-2-(1-benzylsulfonyl-2-formyl-pyrrolidin-2-yl)-2-oxo-ethyl]-3-phenyl-propanamide CAS Name: 2-amino-N-[1-[2-formyl-1-(phenylmethyl)sulfonyl-2-pyrrolidinyl]-1-oxo-3-phenylpropan-2-yl]-3-phenylpropanamide IUPAC Name: 2-amino-N-[1-(1-benzylsulfonyl-2-formylpyrrolidin-2-yl)-1-oxo-3-phenylpropan-2-yl]-3-phenylpropanamide Traditional Name: 2-amino-N-[1-benzyl-2-(1-benzylsulfonyl-2-formyl-pyrrolidin-2-yl)-2-keto-ethyl]-3-phenyl-propionamide Formula: C30H33N3O5S MolecularWeight: 547.66512

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)(C=O)C(=O)C(CC3=CC=CC=C3)NC(=O)C(CC4=CC=CC=C4)N

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)(C=O)C(=O)C(CC3=CC=CC=C3)NC(=O)C(CC4=CC=CC=C4)N

InChI

InChI=1S/C30H33N3O5S/c31-26(19-23-11-4-1-5-12-23)29(36)32-27(20-24-13-6-2-7-14-24)28(35)30(22-34)17-10-18-33(30)39(37,38)21-25-15-8-3-9-16-25/h1-9,11-16,22,26-27H,10,17-21,31H2,(H,32,36)