2-azanylidene-3-oxidanyl-6-piperidin-1-yl-pyrimidin-4-amine; 3-(phenylcarbonyl)-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 2-azanylidene-3-oxidanyl-6-piperidin-1-yl-pyrimidin-4-amine; 3-(phenylcarbonyl)-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-benzoylthiazolidine-4-carboxylic acid; 3-hydroxy-2-imino-6-(1-piperidyl)pyrimidin-4-amine CAS Name: 3-benzoyl-4-thiazolidinecarboxylic acid; 3-hydroxy-2-imino-6-(1-piperidinyl)-4-pyrimidinamine IUPAC Name: 3-benzoyl-1,3-thiazolidine-4-carboxylic acid; 3-hydroxy-2-imino-6-piperidin-1-ylpyrimidin-4-amine Traditional Name: 3-benzoylthiazolidine-4-carboxylic acid; (3-hydroxy-2-imino-6-piperidino-pyrimidin-4-yl)amine Formula: C20H26N6O4S MolecularWeight: 446.52324

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=N)N(C(=C2)N)O.C1C(N(CS1)C(=O)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CCN(CC1)C2=NC(=N)N(C(=C2)N)O.C1C(N(CS1)C(=O)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C11H11NO3S.C9H15N5O/c13-10(8-4-2-1-3-5-8)12-7-16-6-9(12)11(14)15;10-7-6-8(12-9(11)14(7)15)13-4-2-1-3-5-13/h1-5,9H,6-7H2,(H,14,15);6,11,15H,1-5,10H2