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

Systemtic Name: N-[(1R)-2-(cyclopentylamino)-2-oxidanylidene-1-pyridin-2-yl-ethyl]-N-phenyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[(1R)-2-(cyclopentylamino)-2-oxo-1-(2-pyridyl)ethyl]-N-phenyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[(1R)-2-(cyclopentylamino)-2-oxo-1-(2-pyridinyl)ethyl]-N-phenyl-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[(1R)-2-(cyclopentylamino)-2-oxo-1-pyridin-2-ylethyl]-N-phenyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[(1R)-2-(cyclopentylamino)-2-keto-1-(2-pyridyl)ethyl]-N-phenyl-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C(C2=CC=CC=N2)N(C3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CCC(C1)NC(=O)[C@@H](C2=CC=CC=N2)N(C3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C27H27N3O4/c31-26(29-20-8-4-5-9-20)25(22-12-6-7-15-28-22)30(21-10-2-1-3-11-21)27(32)19-13-14-23-24(18-19)34-17-16-33-23/h1-3,6-7,10-15,18,20,25H,4-5,8-9,16-17H2,(H,29,31)/t25-/m1/s1