N-[(2S)-1-(2-dimethylaminoethylamino)-1-oxidanylidene-pentan-2-yl]-6-(4-fluoranylphenoxy)naphthalene-2-carboxamide

Systemtic Name: N-[(2S)-1-(2-dimethylaminoethylamino)-1-oxidanylidene-pentan-2-yl]-6-(4-fluoranylphenoxy)naphthalene-2-carboxamide Openeye Name: N-[(1S)-1-(2-dimethylaminoethylcarbamoyl)butyl]-6-(4-fluorophenoxy)naphthalene-2-carboxamide CAS Name: N-[(2S)-1-(2-dimethylaminoethylamino)-1-oxopentan-2-yl]-6-(4-fluorophenoxy)-2-naphthalenecarboxamide IUPAC Name: N-[(2S)-1-(2-dimethylaminoethylamino)-1-oxopentan-2-yl]-6-(4-fluorophenoxy)naphthalene-2-carboxamide Traditional Name: N-[(1S)-1-(2-dimethylaminoethylcarbamoyl)butyl]-6-(4-fluorophenoxy)-2-naphthamide Formula: C26H30FN3O3 MolecularWeight: 451.533103

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NCCN(C)C)NC(=O)C1=CC2=C(C=C1)C=C(C=C2)OC3=CC=C(C=C3)F

Isomeric SMILES

CCC[C@@H](C(=O)NCCN(C)C)NC(=O)C1=CC2=C(C=C1)C=C(C=C2)OC3=CC=C(C=C3)F

InChI

InChI=1S/C26H30FN3O3/c1-4-5-24(26(32)28-14-15-30(2)3)29-25(31)20-7-6-19-17-23(11-8-18(19)16-20)33-22-12-9-21(27)10-13-22/h6-13,16-17,24H,4-5,14-15H2,1-3H3,(H,28,32)(H,29,31)/t24-/m0/s1