2-azanyl-N-(cyanoiminomethyl)-1-[(2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-6-yl)sulfonyl]-N-ethyl-piperidine-2-carboxamide

Systemtic Name: 2-azanyl-N-(cyanoiminomethyl)-1-[(2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-6-yl)sulfonyl]-N-ethyl-piperidine-2-carboxamide Openeye Name: 2-amino-N-(cyanoiminomethyl)-N-ethyl-1-(3-hydroxy-2,2-dimethyl-chroman-6-yl)sulfonyl-piperidine-2-carboxamide CAS Name: 2-amino-N-(cyanoiminomethyl)-N-ethyl-1-[(3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)sulfonyl]-2-piperidinecarboxamide IUPAC Name: 2-amino-N-(cyanoiminomethyl)-N-ethyl-1-[(3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl)sulfonyl]piperidine-2-carboxamide Traditional Name: 2-amino-N-(cyanoiminomethyl)-N-ethyl-1-(3-hydroxy-2,2-dimethyl-chroman-6-yl)sulfonyl-pipecolinamide Formula: C21H29N5O5S MolecularWeight: 463.55046

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C=NC#N)C(=O)C1(CCCCN1S(=O)(=O)C2=CC3=C(C=C2)OC(C(C3)O)(C)C)N

Isomeric SMILES

CCN(C=NC#N)C(=O)C1(CCCCN1S(=O)(=O)C2=CC3=C(C=C2)OC(C(C3)O)(C)C)N

InChI

InChI=1S/C21H29N5O5S/c1-4-25(14-24-13-22)19(28)21(23)9-5-6-10-26(21)32(29,30)16-7-8-17-15(11-16)12-18(27)20(2,3)31-17/h7-8,11,14,18,27H,4-6,9-10,12,23H2,1-3H3