(2S)-1-[(2S)-1-[(2S)-2-[[(2S)-2-azanyl-3-methyl-butanoyl]-methyl-amino]-3-methyl-butanoyl]pyrrolidin-2-yl]carbonyl-N-(phenylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[(2S)-1-[(2S)-2-[[(2S)-2-azanyl-3-methyl-butanoyl]-methyl-amino]-3-methyl-butanoyl]pyrrolidin-2-yl]carbonyl-N-(phenylmethyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[(2S)-1-[(2S)-2-[[(2S)-2-amino-3-methyl-butanoyl]-methyl-amino]-3-methyl-butanoyl]pyrrolidine-2-carbonyl]-N-benzyl-pyrrolidine-2-carboxamide CAS Name: (2S)-1-[[(2S)-1-[(2S)-2-[[(2S)-2-amino-3-methyl-1-oxobutyl]-methylamino]-3-methyl-1-oxobutyl]-2-pyrrolidinyl]-oxomethyl]-N-(phenylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[(2S)-1-[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]-N-benzylpyrrolidine-2-carboxamide Traditional Name: (2S)-1-[(2S)-1-[(2S)-2-[[(2S)-2-amino-3-methyl-butanoyl]-methyl-amino]-3-methyl-butanoyl]prolyl]-N-benzyl-pyrrolidine-2-carboxamide Formula: C28H43N5O4 MolecularWeight: 513.67212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N(C)C(C(C)C)C(=O)N1CCCC1C(=O)N2CCCC2C(=O)NCC3=CC=CC=C3)N

Isomeric SMILES

CC(C)[C@@H](C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)NCC3=CC=CC=C3)N

InChI

InChI=1S/C28H43N5O4/c1-18(2)23(29)27(36)31(5)24(19(3)4)28(37)33-16-10-14-22(33)26(35)32-15-9-13-21(32)25(34)30-17-20-11-7-6-8-12-20/h6-8,11-12,18-19,21-24H,9-10,13-17,29H2,1-5H3,(H,30,34)/t21-,22-,23-,24-/m0/s1