(2S)-1-[(2R)-2-azanyl-3,3-dimethyl-butanoyl]-N-[(4-carbamimidoylphenyl)methyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[(2R)-2-azanyl-3,3-dimethyl-butanoyl]-N-[(4-carbamimidoylphenyl)methyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[(2R)-2-amino-3,3-dimethyl-butanoyl]-N-[(4-carbamimidoylphenyl)methyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[(2R)-2-amino-3,3-dimethyl-1-oxobutyl]-N-[(4-carbamimidoylphenyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[(2R)-2-amino-3,3-dimethylbutanoyl]-N-[(4-carbamimidoylphenyl)methyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-N-(4-amidinobenzyl)-1-[(2R)-2-amino-3,3-dimethyl-butanoyl]pyrrolidine-2-carboxamide Formula: C19H29N5O2 MolecularWeight: 359.46586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1CCCC1C(=O)NCC2=CC=C(C=C2)C(=N)N)N

Isomeric SMILES

CC(C)(C)[C@H](C(=O)N1CCC[C@H]1C(=O)NCC2=CC=C(C=C2)C(=N)N)N

InChI

InChI=1S/C19H29N5O2/c1-19(2,3)15(20)18(26)24-10-4-5-14(24)17(25)23-11-12-6-8-13(9-7-12)16(21)22/h6-9,14-15H,4-5,10-11,20H2,1-3H3,(H3,21,22)(H,23,25)/t14-,15-/m0/s1