6-azanyl-2-[(4-methoxyphenyl)carbamoyl-[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonyl-amino]hexanoic acid

Systemtic Name: 6-azanyl-2-[(4-methoxyphenyl)carbamoyl-[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonyl-amino]hexanoic acid Openeye Name: 6-amino-2-[(4-methoxyphenyl)carbamoyl-[1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]amino]hexanoic acid CAS Name: 6-amino-2-[[(4-methoxyanilino)-oxomethyl]-[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[(4-methoxyphenyl)carbamoyl-[1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]hexanoic acid Traditional Name: 6-amino-2-[(4-methoxyphenyl)carbamoyl-(1-tosylprolyl)amino]hexanoic acid Formula: C26H34N4O7S MolecularWeight: 546.63576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N(C(CCCCN)C(=O)O)C(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N(C(CCCCN)C(=O)O)C(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C26H34N4O7S/c1-18-8-14-21(15-9-18)38(35,36)29-17-5-7-22(29)24(31)30(23(25(32)33)6-3-4-16-27)26(34)28-19-10-12-20(37-2)13-11-19/h8-15,22-23H,3-7,16-17,27H2,1-2H3,(H,28,34)(H,32,33)