N-ethyl-4-(4-naphthalen-2-ylpyrimidin-2-yl)-1,4-diazepane-1-carboxamide

Systemtic Name: N-ethyl-4-(4-naphthalen-2-ylpyrimidin-2-yl)-1,4-diazepane-1-carboxamide Openeye Name: N-ethyl-4-[4-(2-naphthyl)pyrimidin-2-yl]-1,4-diazepane-1-carboxamide CAS Name: N-ethyl-4-[4-(2-naphthalenyl)-2-pyrimidinyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-ethyl-4-(4-naphthalen-2-ylpyrimidin-2-yl)-1,4-diazepane-1-carboxamide Traditional Name: N-ethyl-4-[4-(2-naphthyl)pyrimidin-2-yl]-1,4-diazepane-1-carboxamide Formula: C22H25N5O MolecularWeight: 375.4668

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCCN(CC1)C2=NC=CC(=N2)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCNC(=O)N1CCCN(CC1)C2=NC=CC(=N2)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H25N5O/c1-2-23-22(28)27-13-5-12-26(14-15-27)21-24-11-10-20(25-21)19-9-8-17-6-3-4-7-18(17)16-19/h3-4,6-11,16H,2,5,12-15H2,1H3,(H,23,28)