3-[[3,5-bis(azanyl)-2-methyl-phenyl]carbonylamino]-2-oxidanyl-2-(4-phenylbutanoyl)-1,3-thiazolidine-4-carboxamide

Systemtic Name: 3-[[3,5-bis(azanyl)-2-methyl-phenyl]carbonylamino]-2-oxidanyl-2-(4-phenylbutanoyl)-1,3-thiazolidine-4-carboxamide Openeye Name: 3-[(3,5-diamino-2-methyl-benzoyl)amino]-2-hydroxy-2-(4-phenylbutanoyl)thiazolidine-4-carboxamide CAS Name: 3-[[(3,5-diamino-2-methylphenyl)-oxomethyl]amino]-2-hydroxy-2-(1-oxo-4-phenylbutyl)-4-thiazolidinecarboxamide IUPAC Name: 3-[(3,5-diamino-2-methylbenzoyl)amino]-2-hydroxy-2-(4-phenylbutanoyl)-1,3-thiazolidine-4-carboxamide Traditional Name: 3-[(3,5-diamino-2-methyl-benzoyl)amino]-2-hydroxy-2-(4-phenylbutanoyl)thiazolidine-4-carboxamide Formula: C22H27N5O4S MolecularWeight: 457.54588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(=O)NN2C(CSC2(C(=O)CCCC3=CC=CC=C3)O)C(=O)N)N)N

Isomeric SMILES

CC1=C(C=C(C=C1C(=O)NN2C(CSC2(C(=O)CCCC3=CC=CC=C3)O)C(=O)N)N)N

InChI

InChI=1S/C22H27N5O4S/c1-13-16(10-15(23)11-17(13)24)21(30)26-27-18(20(25)29)12-32-22(27,31)19(28)9-5-8-14-6-3-2-4-7-14/h2-4,6-7,10-11,18,31H,5,8-9,12,23-24H2,1H3,(H2,25,29)(H,26,30)