N-cyclopentyl-N-[(1R)-2-(cyclopentylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-cyclopentyl-N-[(1R)-2-(cyclopentylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-cyclopentyl-N-[(1R)-2-(cyclopentylamino)-2-oxo-1-(4-pyridyl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-cyclopentyl-N-[(1R)-2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-cyclopentyl-N-[(1R)-2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-cyclopentyl-N-[(1R)-2-(cyclopentylamino)-2-keto-1-(4-pyridyl)ethyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C(C2=CC=NC=C2)N(C3CCCC3)C(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CCC(C1)NC(=O)[C@@H](C2=CC=NC=C2)N(C3CCCC3)C(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C26H31N3O4/c30-25(28-20-5-1-2-6-20)24(18-11-13-27-14-12-18)29(21-7-3-4-8-21)26(31)19-9-10-22-23(17-19)33-16-15-32-22/h9-14,17,20-21,24H,1-8,15-16H2,(H,28,30)/t24-/m1/s1