5-azanyl-2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-5-oxo-2-[[1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]amino]pentanoic acid CAS Name: 5-amino-2-[[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[[1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]-5-oxopentanoic acid Traditional Name: 5-amino-5-keto-2-[(1-tosylprolyl)amino]valeric acid Formula: C17H23N3O6S MolecularWeight: 397.44602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC(CCC(=O)N)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC(CCC(=O)N)C(=O)O

InChI

InChI=1S/C17H23N3O6S/c1-11-4-6-12(7-5-11)27(25,26)20-10-2-3-14(20)16(22)19-13(17(23)24)8-9-15(18)21/h4-7,13-14H,2-3,8-10H2,1H3,(H2,18,21)(H,19,22)(H,23,24)